Benzoyl isothiocyanate, 98%

Description

CAS: 532-55-8 | C8H5NOS | 163.194 g/mol

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: 532-55-8
• Molecular Formula: C8H5NOS
• Molecular Weight (g/mol): 163.194
• MDL Number: MFCD00004815
• InChI Key: CPEKAXYCDKETEN-UHFFFAOYSA-N
• Synonym: benzoylthiocarbimide, benzoylisothiocyanate, benzoylisothiocyante, isothiocyanic acid benzoyl ester, unii-u8j7q32b86, n-benzoyl isothiocyanate, benzoic acid, anhydride with hncs, benzoic acid, anhydride with isothiocyanic acid, oxophenylmethanisothiocyanate, 1-benzoyl acetone
• PubChem CID: 68284
• IUPAC Name: benzoyl isothiocyanate
• SMILES: C1=CC=C(C=C1)C(=O)N=C=S

• Density: 1.214
• Boiling Point: 128°C to 131°C (15 mmHg)
• Flash Point: >110°C (230°F)
• Odor: Pungent
• Refractive Index: 1.6375
• Quantity: 5 g
• UN Number: UN2922
• Beilstein: 606716
• Sensitivity: Moisture sensitive
• Merck Index: 14,1114
• Formula Weight: 163.2
• Percent Purity: 98%
• Chemical Name or Material: Benzoyl isothiocyanate

Safety and Handling

Hazard Category	H301-H317-H318
Hazard Statement	GHS H Statement H331-H334-H314-H318-H302-H312 Toxic if inhaled. May cause allergy or asthma symptoms or breathing difficulties if inhaled. Causes severe skin burns and eye damage. Causes serious eye damage. Harmful if swallowed. Harmful in contact with skin.
Precautionary Statement	P261-P264b-P270-P272-P280-P301+P310-P302+P352-P305+P351+P338-P310-P330-P333+P313-P363-P501c
DOTInformation	Hazard Class: 6.1; Packaging Group: III
EINECSNumber	208-540-0
TSCA	No
Recommended Storage	Ambient temperatures

SDS

RUO – Research Use Only