Isothiocyanates
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Filtered Search Results
Methyle3-isothiocyanatothiophene-2-carboxylate, 97%, Thermo Scientific™
CAS: 81321-10-0 Molecular Formula: C7H5NO2S2 Molecular Weight (g/mol): 199.24 MDL Number: MFCD00052589 InChI Key: RKBLURUDWDTMOB-UHFFFAOYSA-N Synonym: methyl 3-isothiocyanato-2-thiophenecarboxylate,3-isothiocyanato-2-thiophenecarboxylic acid methyl ester,2-thiophenecarboxylicacid, 3-isothiocyanato-, methyl ester,methyl 3-isoisothiocyanatothiophene-2-carboxylate PubChem CID: 2777461 IUPAC Name: methyl 3-isothiocyanatothiophene-2-carboxylate SMILES: COC(=O)C1=C(C=CS1)N=C=S
| PubChem CID | 2777461 |
|---|---|
| CAS | 81321-10-0 |
| Molecular Weight (g/mol) | 199.24 |
| MDL Number | MFCD00052589 |
| SMILES | COC(=O)C1=C(C=CS1)N=C=S |
| Synonym | methyl 3-isothiocyanato-2-thiophenecarboxylate,3-isothiocyanato-2-thiophenecarboxylic acid methyl ester,2-thiophenecarboxylicacid, 3-isothiocyanato-, methyl ester,methyl 3-isoisothiocyanatothiophene-2-carboxylate |
| IUPAC Name | methyl 3-isothiocyanatothiophene-2-carboxylate |
| InChI Key | RKBLURUDWDTMOB-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO2S2 |
4-(1H-Pyrazol-1-yl)phenyl isothiocyanate, 97%, Thermo Scientific™
CAS: 352018-96-3 Molecular Formula: C10H7N3S Molecular Weight (g/mol): 201.25 MDL Number: MFCD02681939 InChI Key: GLAOJNMWLIFKCG-UHFFFAOYSA-N Synonym: 4-1h-pyrazol-1-yl phenyl isothiocyanate,1-4-isothiocyanatophenyl pyrazole,4-1h-pyrazol-1-yl phenylisothiocyanate,1h-pyrazole,1-4-isothiocyanatophenyl,1h-pyrazole, 1-4-isothiocyanatophenyl,4-pyrazolylbenzenisothiocyanate,4-1h-pyrazole-1-yl phenyl isothiocyanate PubChem CID: 2776478 IUPAC Name: 1-(4-isothiocyanatophenyl)pyrazole SMILES: S=C=NC1=CC=C(C=C1)N1C=CC=N1
| PubChem CID | 2776478 |
|---|---|
| CAS | 352018-96-3 |
| Molecular Weight (g/mol) | 201.25 |
| MDL Number | MFCD02681939 |
| SMILES | S=C=NC1=CC=C(C=C1)N1C=CC=N1 |
| Synonym | 4-1h-pyrazol-1-yl phenyl isothiocyanate,1-4-isothiocyanatophenyl pyrazole,4-1h-pyrazol-1-yl phenylisothiocyanate,1h-pyrazole,1-4-isothiocyanatophenyl,1h-pyrazole, 1-4-isothiocyanatophenyl,4-pyrazolylbenzenisothiocyanate,4-1h-pyrazole-1-yl phenyl isothiocyanate |
| IUPAC Name | 1-(4-isothiocyanatophenyl)pyrazole |
| InChI Key | GLAOJNMWLIFKCG-UHFFFAOYSA-N |
| Molecular Formula | C10H7N3S |
4-(Trifluoromethoxy)phenyl isothiocyanate, 97%, Thermo Scientific™
CAS: 64285-95-6 Molecular Formula: C8H4F3NOS Molecular Weight (g/mol): 219.181 MDL Number: MFCD00042412 InChI Key: JKSZUQPHKOPVHF-UHFFFAOYSA-N PubChem CID: 2777338 IUPAC Name: 1-isothiocyanato-4-(trifluoromethoxy)benzene SMILES: C1=CC(=CC=C1N=C=S)OC(F)(F)F
| PubChem CID | 2777338 |
|---|---|
| CAS | 64285-95-6 |
| Molecular Weight (g/mol) | 219.181 |
| MDL Number | MFCD00042412 |
| SMILES | C1=CC(=CC=C1N=C=S)OC(F)(F)F |
| IUPAC Name | 1-isothiocyanato-4-(trifluoromethoxy)benzene |
| InChI Key | JKSZUQPHKOPVHF-UHFFFAOYSA-N |
| Molecular Formula | C8H4F3NOS |
Benzyl isothiocyanate, 98%
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
| PubChem CID | 2346 |
|---|---|
| CAS | 622-78-6 |
| Molecular Weight (g/mol) | 149.22 |
| ChEBI | CHEBI:17484 |
| MDL Number | MFCD00004819 |
| SMILES | C1=CC=C(C=C1)CN=C=S |
| Synonym | benzyl isothiocyanate,isothiocyanatomethyl benzene,benzyl mustard oil,benzylisothiocyanate,benzylsenfoel,tromacaps,tromalyt,urogran,isothiocyanic acid, benzyl ester,benzyl-isothiocyanate |
| IUPAC Name | isothiocyanatomethylbenzene |
| InChI Key | MDKCFLQDBWCQCV-UHFFFAOYSA-N |
| Molecular Formula | C8H7NS |
3-Methoxypropyl isothiocyanate, 97%, Thermo Scientific™
CAS: 17702-11-3 Molecular Formula: C5H9NOS Molecular Weight (g/mol): 131.193 MDL Number: MFCD00022063 InChI Key: UKVFWFDXYBLOLU-UHFFFAOYSA-N Synonym: 3-methoxypropyl isothiocyanate,3-methoxypropylisothiocyanate,1-isothiocyanato-3-methoxy-propane,propane,1-isothiocyanato-3-methoxy,propane, 1-isothiocyanato-3-methoxy,3-methoxypropanisothiocyanate,acmc-1bu13,3-methoxy-n-propyl isothiocyanate,3-methoxpropyl isothiocyanate,# PubChem CID: 140274 IUPAC Name: 1-isothiocyanato-3-methoxypropane SMILES: COCCCN=C=S
| PubChem CID | 140274 |
|---|---|
| CAS | 17702-11-3 |
| Molecular Weight (g/mol) | 131.193 |
| MDL Number | MFCD00022063 |
| SMILES | COCCCN=C=S |
| Synonym | 3-methoxypropyl isothiocyanate,3-methoxypropylisothiocyanate,1-isothiocyanato-3-methoxy-propane,propane,1-isothiocyanato-3-methoxy,propane, 1-isothiocyanato-3-methoxy,3-methoxypropanisothiocyanate,acmc-1bu13,3-methoxy-n-propyl isothiocyanate,3-methoxpropyl isothiocyanate,# |
| IUPAC Name | 1-isothiocyanato-3-methoxypropane |
| InChI Key | UKVFWFDXYBLOLU-UHFFFAOYSA-N |
| Molecular Formula | C5H9NOS |
Cyclohexyl isothiocyanate, 98%
CAS: 1122-82-3 Molecular Formula: C7H11NS Molecular Weight (g/mol): 141.232 MDL Number: MFCD00003841 InChI Key: MZSJGCPBOVTKHR-UHFFFAOYSA-N Synonym: cyclohexyl isothiocyanate,cyclohexane, isothiocyanato,isothiocyanocyclohexane,cyclohexyl-isothiocyanat,isothiocyanic acid, cyclohexyl ester,cyclohexylisothiocyanate,cyclohexyl isothiocyanate, isothiocyanato,cyclohexyl-isothiocyanat german,isothiocyanato-cyclohexane,isothiocyanic acid cyclohexyl ester PubChem CID: 14289 IUPAC Name: isothiocyanatocyclohexane SMILES: C1CCC(CC1)N=C=S
| PubChem CID | 14289 |
|---|---|
| CAS | 1122-82-3 |
| Molecular Weight (g/mol) | 141.232 |
| MDL Number | MFCD00003841 |
| SMILES | C1CCC(CC1)N=C=S |
| Synonym | cyclohexyl isothiocyanate,cyclohexane, isothiocyanato,isothiocyanocyclohexane,cyclohexyl-isothiocyanat,isothiocyanic acid, cyclohexyl ester,cyclohexylisothiocyanate,cyclohexyl isothiocyanate, isothiocyanato,cyclohexyl-isothiocyanat german,isothiocyanato-cyclohexane,isothiocyanic acid cyclohexyl ester |
| IUPAC Name | isothiocyanatocyclohexane |
| InChI Key | MZSJGCPBOVTKHR-UHFFFAOYSA-N |
| Molecular Formula | C7H11NS |
Phenyl isothiocyanate, 98%
CAS: 103-72-0 Molecular Formula: C7H5NS Molecular Weight (g/mol): 135.18 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: S=C=NC1=CC=CC=C1
| PubChem CID | 7673 |
|---|---|
| CAS | 103-72-0 |
| Molecular Weight (g/mol) | 135.18 |
| ChEBI | CHEBI:85103 |
| MDL Number | MFCD00004798 |
| SMILES | S=C=NC1=CC=CC=C1 |
| Synonym | phenyl isothiocyanate,phenylisothiocyanate,thiocarbanil,phenyl mustard oil,benzene, isothiocyanato,pitc,isothiocyanic acid phenyl ester,benzene-1-isothiocyanate,phenylsenfoel,phenyl thioisocyanate |
| IUPAC Name | isothiocyanatobenzene |
| InChI Key | QKFJKGMPGYROCL-UHFFFAOYSA-N |
| Molecular Formula | C7H5NS |
Allyl isothiocyanate, 94%, stabilized with 0.01% alpha-tocopherol
CAS: 57-06-7 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
| PubChem CID | 5971 |
|---|---|
| CAS | 57-06-7 |
| ChEBI | CHEBI:73224 |
| MDL Number | MFCD00004822 |
| SMILES | C=CCN=C=S |
| Synonym | allyl isothiocyanate,mustard oil,redskin,allylsenevol,allylsenfoel,allyl mustard oil,oleum sinapis,oil of mustard,allylsevenolum,senfoel |
| IUPAC Name | 3-isothiocyanatoprop-1-ene |
| InChI Key | ZOJBYZNEUISWFT-UHFFFAOYSA-N |
1-Naphthyl isothiocyanate, 98%
CAS: 551-06-4 Molecular Formula: C11H7NS Molecular Weight (g/mol): 185.25 MDL Number: MFCD00003882 InChI Key: JBDOSUUXMYMWQH-UHFFFAOYSA-N Synonym: 1-naphthyl isothiocyanate,1-naphthylisothiocyanate,anit,kesscocide,alpha-naphthyl isothiocyanate,naphthalene, 1-isothiocyanato,naphthalene, isothiocyanato,isothiocyanic acid, 1-naphthyl ester,1-naftylisothiokyanat,isothiocyanic acid 1-naphthyl ester PubChem CID: 11080 ChEBI: CHEBI:35455 IUPAC Name: 1-isothiocyanatonaphthalene SMILES: C1=CC=C2C(=C1)C=CC=C2N=C=S
| PubChem CID | 11080 |
|---|---|
| CAS | 551-06-4 |
| Molecular Weight (g/mol) | 185.25 |
| ChEBI | CHEBI:35455 |
| MDL Number | MFCD00003882 |
| SMILES | C1=CC=C2C(=C1)C=CC=C2N=C=S |
| Synonym | 1-naphthyl isothiocyanate,1-naphthylisothiocyanate,anit,kesscocide,alpha-naphthyl isothiocyanate,naphthalene, 1-isothiocyanato,naphthalene, isothiocyanato,isothiocyanic acid, 1-naphthyl ester,1-naftylisothiokyanat,isothiocyanic acid 1-naphthyl ester |
| IUPAC Name | 1-isothiocyanatonaphthalene |
| InChI Key | JBDOSUUXMYMWQH-UHFFFAOYSA-N |
| Molecular Formula | C11H7NS |
Methyle2-isothiocyanatobenzoate, 97%, Thermo Scientific™
CAS: 16024-82-1 Molecular Formula: C9H7NO2S Molecular Weight (g/mol): 193.22 MDL Number: MFCD00041062 InChI Key: UNXVHBOJSCWVCD-UHFFFAOYSA-N Synonym: 2-isothiocyanato-benzoic acid methyl ester,2-methoxycarbonylphenyl isothiocyanate,2-methoxycarbonyl phenyl isothiocyanate,benzoic acid,2-isothiocyanato-, methyl ester,benzoic acid, 2-isothiocyanato-, methyl ester,acmc-209dkr,methyl2-isothiocyanatobenzoate,methyl 2-isothiocyanato benzoate,methyl 2-isothiocyanatobenzenecarboxylate,2-isothiocyanatobenzoic acid methyl ester PubChem CID: 85243 IUPAC Name: methyl 2-isothiocyanatobenzoate SMILES: COC(=O)C1=CC=CC=C1N=C=S
| PubChem CID | 85243 |
|---|---|
| CAS | 16024-82-1 |
| Molecular Weight (g/mol) | 193.22 |
| MDL Number | MFCD00041062 |
| SMILES | COC(=O)C1=CC=CC=C1N=C=S |
| Synonym | 2-isothiocyanato-benzoic acid methyl ester,2-methoxycarbonylphenyl isothiocyanate,2-methoxycarbonyl phenyl isothiocyanate,benzoic acid,2-isothiocyanato-, methyl ester,benzoic acid, 2-isothiocyanato-, methyl ester,acmc-209dkr,methyl2-isothiocyanatobenzoate,methyl 2-isothiocyanato benzoate,methyl 2-isothiocyanatobenzenecarboxylate,2-isothiocyanatobenzoic acid methyl ester |
| IUPAC Name | methyl 2-isothiocyanatobenzoate |
| InChI Key | UNXVHBOJSCWVCD-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO2S |