Isothiocyanates

Alfa Aesar™ Allyl isothiocyanate, 94%, stab.

CAS: 57-06-7 Molecular Formula: C4H5NS Molecular Weight (g/mol): 99.151 MDL Number: MFCD00004822 InChI Key: ZOJBYZNEUISWFT-UHFFFAOYSA-N Synonym: allyl isothiocyanate, mustard oil, redskin, allylsenevol, allylsenfoel, allyl mustard oil, oleum sinapis, oil of mustard, allylsevenolum, senfoel PubChem CID: 5971 ChEBI: CHEBI:73224 IUPAC Name: 3-isothiocyanatoprop-1-ene SMILES: C=CCN=C=S ALLYL ISOTHIOCYANATE, 94% 5G

Alfa Aesar™ o-Tolyl isothiocyanate, 98%

CAS: 614-69-7 Molecular Formula: C8H7NS Molecular Weight (g/mol): 149.211 MDL Number: MFCD00004802 InChI Key: JYKYYPPZLPVIBY-UHFFFAOYSA-N Synonym: 2-methylphenyl isothiocyanate, o-tolyl isothiocyanate, 2-tolyl isothiocyanate, o-tolylisothiocyanate, benzene, 1-isothiocyanato-2-methyl, 1-isothiocyanato-2-methyl-benzene, 2-methylphenylisothiocyanate, isothiocyanic acid o-tolyl ester, isothiocyanic acid, o-tolyl ester, 2-methylbenzenisothiocyanate PubChem CID: 69195 IUPAC Name: 1-isothiocyanato-2-methylbenzene SMILES: CC1=CC=CC=C1N=C=S O-TOLYL ISOTHIOCYANATE, 99%,100G

Alfa Aesar™ (S)-(+)-2-Octyl isothiocyanate, 97%

1GR (S)-(+)-2-Octyl isothiocyanate, 97% 1g

Alfa Aesar™ Isobutyl isothiocyanate, 97%

CAS: 591-82-2 Molecular Formula: C5H9NS Molecular Weight (g/mol): 115.194 MDL Number: MFCD00022062 InChI Key: NSDDRJXKROCWRZ-UHFFFAOYSA-N Synonym: isobutyl isothiocyanate, i-butyl isothiocyanate, isobutylisothiocyanate, 2-methylpropyl isothiocyanate, isothiocyanic acid, isobutyl ester, 1-isothiocyanato-2-methyl-propane, unii-a498zc6z4f, isothiocyanic acid isobutyl ester, propane, 1-isothiocyanato-2-methyl, propane, 1-isothiocyanato-2-methyl-9ci PubChem CID: 68960 IUPAC Name: 1-isothiocyanato-2-methylpropane SMILES: CC(C)CN=C=S ISOBUTYL ISOTHIOCYANATE, 97%,100G

Alfa Aesar™ 2-(3,4-Dimethoxyphenyl)ethyl isothiocyanate, 98%

CAS: 21714-25-0 Molecular Formula: C11H13NO2S Molecular Weight (g/mol): 223.29 MDL Number: MFCD00041366 InChI Key: GHYFLDWHIVKQLS-UHFFFAOYSA-N Synonym: 3,4-dimethoxyphenethyl isothiocyanate, 4-2-isothiocyanatoethyl-1,2-dimethoxybenzene, 2-3,4-dimethoxyphenyl ethyl isothiocyanate, benzene, 4-2-isothiocyanatoethyl-1,2-dimethoxy, 2-3,4-dimethoxyphenyl ethanisothiocyanate, acmc-20anep, 3,4-dimethoxyphenethylisothiocyanate, b-3,4-dimethoxyphenyl ethyl isothiocyanate, 3,4-dimethoxy-1-2-isothiocyanatoethyl benzene, 4-2-isothiocyanatoethyl-1,2-dimethoxy-benzene PubChem CID: 140856 IUPAC Name: 4-(2-isothiocyanatoethyl)-1,2-dimethoxybenzene SMILES: COC1=C(C=C(C=C1)CCN=C=S)OC 2-(3,4-DIMETHOXYPHENYL)ETHYL ISOTHIOCYANATE, 98%,1

3,4-Dimethoxyphenethyl isothiocyanate, 95%, Maybridge

CAS: 21714-25-0 Molecular Formula: C11H13NO2S Molecular Weight (g/mol): 223.29 InChI Key: GHYFLDWHIVKQLS-UHFFFAOYSA-N Synonym: 3,4-dimethoxyphenethyl isothiocyanate, 4-2-isothiocyanatoethyl-1,2-dimethoxybenzene, 2-3,4-dimethoxyphenyl ethyl isothiocyanate, benzene, 4-2-isothiocyanatoethyl-1,2-dimethoxy, 2-3,4-dimethoxyphenyl ethanisothiocyanate, acmc-20anep, 3,4-dimethoxyphenethylisothiocyanate, b-3,4-dimethoxyphenyl ethyl isothiocyanate, 3,4-dimethoxy-1-2-isothiocyanatoethyl benzene, 4-2-isothiocyanatoethyl-1,2-dimethoxy-benzene PubChem CID: 140856 IUPAC Name: 4-(2-isothiocyanatoethyl)-1,2-dimethoxybenzene SMILES: COC1=C(C=C(C=C1)CCN=C=S)OC 1GR 3,4-Dimethoxyphenethyl isothiocyanate, 95%

Alfa Aesar™ 4-Cyanophenyl isothiocyanate, 98%

CAS: 2719-32-6 Molecular Formula: C8H4N2S Molecular Weight (g/mol): 160.194 MDL Number: MFCD00041085 InChI Key: DZFKAXLNKZXNHD-UHFFFAOYSA-N Synonym: 4-cyanophenyl isothiocyanate, benzonitrile, 4-isothiocyanato, p-cyanophenyl isothiocyanate, 4-cyanophenylisothiocyanate, 4-cyano-phenyl-isothiocyanate, 4-isothiocyanatobenzenenitrile, 4-isothiocyanato-benzonitrile, benzonitrile,4-isothiocyanato, isothiocyanic acid, p-cyanophenyl ester, benzenenitrile, 4-isothiocyanato PubChem CID: 17626 IUPAC Name: 4-isothiocyanatobenzonitrile SMILES: C1=CC(=CC=C1C#N)N=C=S 4-CYANOPHENYL ISOTHIOCYANATE,25G

Allyl isothiocyanate, 94%, stabilized with 0.01% alpha-tocopherol, Acros Organics

CAS: 57-06-7 Molecular Formula: C4H5NS Molecular Weight (g/mol): 99.15 MDL Number: MFCD00004822 InChI Key: ZOJBYZNEUISWFT-UHFFFAOYSA-N Synonym: allyl isothiocyanate, mustard oil, redskin, allylsenevol, allylsenfoel, allyl mustard oil, oleum sinapis, oil of mustard, allylsevenolum, senfoel PubChem CID: 5971 ChEBI: CHEBI:73224 IUPAC Name: 3-isothiocyanatoprop-1-ene SMILES: C=CCN=C=S 500GR Allyl isothiocyanate, 94%, stabilized with 0.01% alpha-tocopherol

Benzyl isothiocyanate, 98%, ACROS Organics™

CAS: 622-78-6 Molecular Formula: C8H7NS Molecular Weight (g/mol): 149.22 MDL Number: MFCD00004819 InChI Key: MDKCFLQDBWCQCV-UHFFFAOYSA-N Synonym: benzyl isothiocyanate, isothiocyanatomethyl benzene, benzyl mustard oil, benzylisothiocyanate, benzylsenfoel, tromacaps, tromalyt, urogran, isothiocyanic acid, benzyl ester, benzyl-isothiocyanate PubChem CID: 2346 ChEBI: CHEBI:17484 IUPAC Name: isothiocyanatomethylbenzene SMILES: C1=CC=C(C=C1)CN=C=S 100GR Benzyl isothiocyanate, 98%

Alfa Aesar™ 3-Carboxyphenyl isothiocyanate, 97%

CAS: 2131-63-7 Molecular Formula: C8H5NO2S Molecular Weight (g/mol): 179.193 MDL Number: MFCD00041367 InChI Key: PJRBPKOOGLKPFB-UHFFFAOYSA-N Synonym: 3-carboxyphenyl isothiocyanate, 3-carboxyphenylisothiocyanate, benzoic acid, 3-isothiocyanato, benzoic acid,3-isothiocyanato, acmc-20an7x, m-carboxyphenyl isothiocyanate, 3-isothiocyanato-benzoic acid, # PubChem CID: 75046 IUPAC Name: 3-isothiocyanatobenzoic acid SMILES: C1=CC(=CC(=C1)N=C=S)C(=O)O 3-CARBOXYPHENYL ISOTHIOCYANATE, 97%,5G

2,5-dimethoxyphenyl isothiocyanate, Maybridge

CAS: 40532-06-7 Molecular Formula: C9H9NO2S Molecular Weight (g/mol): 195.236 InChI Key: RADQLZMDTYWZKA-UHFFFAOYSA-N Synonym: 2,5-dimethoxyphenyl isothiocyanate, 2,5-dimethoxyphenylisothiocyanate, 2-isothiocyanato-1,4-dimethoxy-benzene, benzene, 2-isothiocyanato-1,4-dimethoxy, 2,5-dimethoxybenzenisothiocyanate, acmc-1amrr, # PubChem CID: 142466 IUPAC Name: 2-isothiocyanato-1,4-dimethoxybenzene SMILES: COC1=CC(=C(C=C1)OC)N=C=S 25GR 2,5-Dimethoxyphenyl isothiocyanate, 97%

Ethyl isothiocyanate, 96%, Acros Organics

CAS: 542-85-8 Molecular Formula: C3H5NS Molecular Weight (g/mol): 87.14 MDL Number: MFCD00004820 InChI Key: HBNYJWAFDZLWRS-UHFFFAOYSA-N Synonym: ethyl isothiocyanate, ethane, isothiocyanato, ethyl mustard oil, ethylisothiocyanate, isothiocyanic acid, ethyl ester, unii-3284mj2t8p, ccris 7323, ethylisothio-cyanate, isothiocyanato-ethane PubChem CID: 10966 ChEBI: CHEBI:85098 IUPAC Name: isothiocyanatoethane SMILES: CCN=C=S 25GR Ethyl isothiocyanate, 96%

Alfa Aesar™ p-Tolyl isothiocyanate, 97%

CAS: 622-59-3 Molecular Formula: C8H7NS Molecular Weight (g/mol): 149.211 MDL Number: MFCD00004813 InChI Key: ABQKHKWXTUVKGF-UHFFFAOYSA-N Synonym: p-tolyl isothiocyanate, 4-methylphenyl isothiocyanate, 4-methylphenylisothiocyanate, p-tolylisothiocyanate, 4-tolylisothiocyanate, benzene, 1-isothiocyanato-4-methyl, 4-tolyl isothiocyanate, isothiocyanic acid, p-tolyl ester, 1-isothiocyanato-4-methyl-benzene, isothiocyanic acid, 4-tolyl ester PubChem CID: 12149 IUPAC Name: 1-isothiocyanato-4-methylbenzene SMILES: CC1=CC=C(C=C1)N=C=S P-TOLYL ISOTHIOCYANATE, 97%,25G

Alfa Aesar™ 1-Heptyl isothiocyanate, 96%

CAS: 4426-83-9 Molecular Formula: C8H15NS Molecular Weight (g/mol): 157.275 MDL Number: MFCD00041138 InChI Key: LIPUQNPCPLDDBO-UHFFFAOYSA-N Synonym: heptyl isothiocyanate, heptane, 1-isothiocyanato, n-heptyl isothiocyanate, 1-heptyl isothiocyanate, heptylisothiocyanate, n-heptylisothiocyanate, heptane,1-isothiocyanato, acmc-20aks1, 1-dihydroxyboryl butane PubChem CID: 78152 IUPAC Name: 1-isothiocyanatoheptane SMILES: CCCCCCCN=C=S N-HEPTYL ISOTHIOCYANATE, 96%,25G

Alfa Aesar™ Benzyl isothiocyanate, 98%

CAS: 622-78-6 Molecular Formula: C8H7NS Molecular Weight (g/mol): 149.211 MDL Number: MFCD00004819 InChI Key: MDKCFLQDBWCQCV-UHFFFAOYSA-N Synonym: benzyl isothiocyanate, isothiocyanatomethyl benzene, benzyl mustard oil, benzylisothiocyanate, benzylsenfoel, tromacaps, tromalyt, urogran, isothiocyanic acid, benzyl ester, benzyl-isothiocyanate PubChem CID: 2346 ChEBI: CHEBI:17484 IUPAC Name: isothiocyanatomethylbenzene SMILES: C1=CC=C(C=C1)CN=C=S BENZYL ISOTHIOCYANATE, 97+%,5G

Alfa Aesar™ 2-(4-Morpholinyl)ethyl isothiocyanate, 97%

CAS: 63224-35-1 Molecular Formula: C7H12N2OS Molecular Weight (g/mol): 172.246 MDL Number: MFCD00041221 InChI Key: SDNSCXCXVQHBGH-UHFFFAOYSA-N Synonym: 2-morpholinoethyl isothiocyanate, 4-2-isothiocyanatoethyl morpholine, 2-4-morpholino ethyl isothiocyanate, 2-morpholinoethylisothiocyanate, 4-2-isothiocyanato-ethyl-morpholine, 2-morpholin-4-ylethanisothiocyanate, 2-4-morpholinyl ethyl isothiocyanate, 4-2-isothiocyanatoethyl morpholine # PubChem CID: 143957 IUPAC Name: 4-(2-isothiocyanatoethyl)morpholine SMILES: C1COCCN1CCN=C=S 2-(4-MORPHOLINO)ETHYL ISOTHIOCYANATE, 97%,10G

4-(Benzyloxy)phenyl isothiocyanate 97%, Maybridge

CAS: 139768-71-1 Molecular Formula: C14H11NOS Molecular Weight (g/mol): 241.308 InChI Key: OQXRBXAFSXVCCO-UHFFFAOYSA-N Synonym: 4-benzyloxyphenyl isothiocyanate, 4-benzyloxyphenylisothiocyanate, 1-benzyloxy-4-isothiocyanatobenzene, 4-phenylmethoxy benzenisothiocyanate, acmc-20amoj, 4-benzyloxyisothiocyanate, 4-phenylmethoxyphenylisothiocyanate, 4-benzyloxy phenyl isothiocyanate, 4-phenylmethoxy phenyl isothiocyanate, 1-isothiocyanato-4-phenylmethoxy-benzene PubChem CID: 2735503 IUPAC Name: 1-isothiocyanato-4-phenylmethoxybenzene SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)N=C=S 5GR 4-(Benzyloxy)phenyl isothiocyanate, 97%

Alfa Aesar™ Ethyl isothiocyanate, 97%

CAS: 542-85-8 Molecular Formula: C3H5NS Molecular Weight (g/mol): 87.14 MDL Number: MFCD00004820 InChI Key: HBNYJWAFDZLWRS-UHFFFAOYSA-N Synonym: ethyl isothiocyanate, ethane, isothiocyanato, ethyl mustard oil, ethylisothiocyanate, isothiocyanic acid, ethyl ester, unii-3284mj2t8p, ccris 7323, ethylisothio-cyanate, isothiocyanato-ethane PubChem CID: 10966 ChEBI: CHEBI:85098 IUPAC Name: isothiocyanatoethane SMILES: CCN=C=S ETHYL ISOTHIOCYANATE, 97% 500G

Phenyl isothiocyanate, 97%, Alfa Aesar™

CAS: 103-72-0 Molecular Formula: C7H5NS Molecular Weight (g/mol): 135.184 MDL Number: MFCD00004798 InChI Key: QKFJKGMPGYROCL-UHFFFAOYSA-N Synonym: phenyl isothiocyanate, phenylisothiocyanate, thiocarbanil, phenyl mustard oil, benzene, isothiocyanato, pitc, isothiocyanic acid phenyl ester, benzene-1-isothiocyanate, phenylsenfoel, phenyl thioisocyanate PubChem CID: 7673 ChEBI: CHEBI:85103 IUPAC Name: isothiocyanatobenzene SMILES: C1=CC=C(C=C1)N=C=S PHENYL ISOTHIOCYANATE, 97%500G

Phenethyleisothiocyanate, 97%, Maybridge

CAS: 2257-09-2 Molecular Formula: C9H9NS Molecular Weight (g/mol): 163.24 MDL Number: MFCD00004821 InChI Key: IZJDOKYDEWTZSO-UHFFFAOYSA-N Synonym: 2-phenylethyl isothiocyanate, phenethyl isothiocyanate, phenylethyl isothiocyanate, 2-isothiocyanatoethyl benzene, phenethyl mustard oil, phenylaethylsenfoel, benzene, 2-isothiocyanatoethyl, peitc, phenylethyl mustard oil, 2-phenylethylisothiocyanate PubChem CID: 16741 ChEBI: CHEBI:351346 IUPAC Name: 2-isothiocyanatoethylbenzene SMILES: C1=CC=C(C=C1)CCN=C=S 10GR Phenethyl isothiocyanate, 97%

4-chloro-3-nitrophenyl isothiocyanate, Maybridge

CAS: 127142-66-9 Molecular Formula: C7H3ClN2O2S Molecular Weight (g/mol): 214.623 InChI Key: ZXGZBHIDSJXKLE-UHFFFAOYSA-N Synonym: 4-chloro-3-nitrophenyl isothiocyanate, 4-chloro-3-nitrophenylisothiocyanate, acmc-1c0qb, 4-chloro-3-nitrobenzenisothiocyanate, #, benzene,1-chloro-4-isothiocyanato-2-nitro, 1-chloranyl-4-isothiocyanato-2-nitro-benzene PubChem CID: 145581 IUPAC Name: 1-chloro-4-isothiocyanato-2-nitrobenzene SMILES: C1=CC(=C(C=C1N=C=S)[N+](=O)[O-])Cl 10GR 4-Chloro-3-nitrophenyl isothiocyanate, 97%

4-Ethoxyphenyl isothiocyanate 97%, Maybridge

CAS: 3460-49-9 Molecular Formula: C9H9NOS Molecular Weight (g/mol): 179.237 InChI Key: REEKOMRZYJXXNR-UHFFFAOYSA-N Synonym: 4-ethoxyphenyl isothiocyanate, 4-isothiocyanatophenetol, p-ethoxyphenyl isothiocyanate, 1-ethoxy-4-isothiocyanato-benzene, benzene, 1-ethoxy-4-isothiocyanato, 4-ethoxyphenylisothiocyanate, 4-ethoxybenzenisothiocyanate, acmc-20amjc, pubchem9560, p-ethoxyphenylisothiocyanate PubChem CID: 77006 IUPAC Name: 1-ethoxy-4-isothiocyanatobenzene SMILES: CCOC1=CC=C(C=C1)N=C=S 10GR 4-Ethoxyphenyl isothiocyanate, 97%

2-Ethoxyphenyl isothiocyanate, 97%, Maybridge

10GR 2-Ethoxyphenyl isothiocyanate, 97%

Alfa Aesar™ (S)-(+)-1-Cyclohexylethyl isothiocyanate, 97%

1GR (S)-(+)-1-Cyclohexylethyl isothiocyanate, 97% 1g

Alfa Aesar™ (S)-(+)-1-Phenylethyl isothiocyanate, 97%

1GR (S)-(+)-1-Phenylethyl isothiocyanate, 97% 1g

Alfa Aesar™ Methyl isothiocyanate, polymer-supported, 1.5-1.9 mmol/g on polystyrene

CAS: 556-61-6 Molecular Formula: C2H3NS Molecular Weight (g/mol): 73.113 MDL Number: MFCD03457480 InChI Key: LGDSHSYDSCRFAB-UHFFFAOYSA-N Synonym: methyl isothiocyanate, isothiocyanatomethane, methane, isothiocyanato, trapex, methyl mustard oil, methyl mustard, mitc, mencs, methylisothiocyanate, trapexide PubChem CID: 11167 ChEBI: CHEBI:78337 IUPAC Name: methylimino(sulfanylidene)methane SMILES: CN=C=S METHYL ISOTHIOCYANATE, POLYMER-SUPPORTED, 1.5-1.9,

Alfa Aesar™ 4-Methoxybenzyl isothiocyanate, 94%

CAS: 3694-57-3 Molecular Formula: C9H9NOS Molecular Weight (g/mol): 179.237 MDL Number: MFCD00041117 InChI Key: IMFQYAJJXFXVMM-UHFFFAOYSA-N Synonym: 4-methoxybenzyl isothiocyanate, 1-isothiocyanatomethyl-4-methoxybenzene, 4-methoxybenzylisothiocyanate, benzene, 1-isothiocyanatomethyl-4-methoxy, p-methoxybenzyl isothiocyanate, 1-isothiocyanatomethyl-4-methoxy-benzene, chembl81201, 4-methoxybenzyl isothiocyanate 5gr, acmc-1cq6l PubChem CID: 123197 IUPAC Name: 1-(isothiocyanatomethyl)-4-methoxybenzene SMILES: COC1=CC=C(C=C1)CN=C=S 4-METHOXYBENZYL ISOTHIOCYANATE, 94%,5G

Alfa Aesar™ 4-(Methoxycarbonyl)phenyl isothiocyanate, 98+%

CAS: 3662-78-0 Molecular Formula: C9H7NO2S Molecular Weight (g/mol): 193.22 MDL Number: MFCD00041099 InChI Key: WIZODHILGBTPPA-UHFFFAOYSA-N Synonym: 4-methoxycarbonylphenyl isothiocyanate, 4-methoxycarbonylphenylisothiocyanate, 4-isothiocyanatobenzoic acid methyl ester, benzoic acid, 4-isothiocyanato-, methyl ester, acmc-20amez, #, 4-methoxycarbonyl phenylisothiocyanate, 4-methoxycarbonyl phenyl isothiocyanate PubChem CID: 138002 IUPAC Name: methyl 4-isothiocyanatobenzoate SMILES: COC(=O)C1=CC=C(C=C1)N=C=S 4-METHOXYCARBONYLPHENYL ISOTHIOCYANATE, 98+%,1G

Alfa Aesar™ 4-n-Butyl-2-methylphenyl isothiocyanate, 95%

CAS: 175205-37-5 Molecular Formula: C12H15NS Molecular Weight (g/mol): 205.319 MDL Number: MFCD00276966 InChI Key: BJMLHJJEHDPCKW-UHFFFAOYSA-N Synonym: 4-n-butyl-2-methylphenyl isothiocyanate, p-n-butyl-o-tolyl isothiocyanate, 4-butyl-2-methylbenzenisothiocyanate, 4-n-butyl-2-methylphenylisothiocyanate, benzene, 4-butyl-1-isothiocyanato-2-methyl-9ci PubChem CID: 7020482 IUPAC Name: 4-butyl-1-isothiocyanato-2-methylbenzene SMILES: CCCCC1=CC(=C(C=C1)N=C=S)C 4-N-BUTYL-2-METHYLPHENYL ISOTHIOCYANATE, 95%,5G

Alfa Aesar™ 4-Ethylphenyl isothiocyanate, 97%

CAS: 18856-63-8 Molecular Formula: C9H9NS Molecular Weight (g/mol): 163.238 MDL Number: MFCD00041101 InChI Key: XXLWCGRHJFEMQH-UHFFFAOYSA-N Synonym: 4-ethylphenyl isothiocyanate, 1-ethyl-4-isothiocyanato-benzene, benzene,1-ethyl-4-isothiocyanato, 4-ethylbenzenisothiocyanate, acmc-20amit, 2-p-isothio-cyanatophenyl ethane, # PubChem CID: 140438 IUPAC Name: 1-ethyl-4-isothiocyanatobenzene SMILES: CCC1=CC=C(C=C1)N=C=S 4-ETHYLPHENYL ISOTHIOCYANATE, 97%,10G

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