4-(Methoxycarbonyl)phenyl isothiocyanate, 98+%, Thermo Scientific Chemicals

Description

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Specifications

Chemical Identifiers

• 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

• Melting Point: 46°C to 50°C
• Odor: Irritating
• Quantity: 1 g
• UN Number: UN2923
• Beilstein: 2100504
• Sensitivity: Moisture sensitive
• Formula Weight: 193.23
• Percent Purity: ≥98%
• Chemical Name or Material: 4-(Methoxycarbonyl)phenyl isothiocyanate

RUO – Research Use Only