2-Chloro-6-methylphenyl isocyanate, 97%

Description

CAS: 40398-01-4 | C8H6ClNO | 167.592 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: 40398-01-4
• Molecular Formula: C8H6ClNO
• Molecular Weight (g/mol): 167.592
• MDL Number: MFCD00037030
• InChI Key: FBTQQNYGMICJQZ-UHFFFAOYSA-N
• Synonym: 2-chloro-6-methylphenyl isocyanate, 2-chloro-6-methylphenylisocyanate, benzene, 1-chloro-2-isocyanato-3-methyl, acmc-1ake5, 2-chloro-6-methylbenzenisocyanate, 2-chloro 6-methyl phenylisocyanate, 2-chloro 6-methyl phenyl isocyanate, 2-chloro-1-isocyanato-6-methyl benzene, 1-chloro-2-isocyanato-3-methyl-benzene, 6-chloro-2-methylphenylisocyanate
• PubChem CID: 268123
• IUPAC Name: 1-chloro-2-isocyanato-3-methylbenzene
• SMILES: CC1=C(C(=CC=C1)Cl)N=C=O

• Density: 1.231
• Boiling Point: 79°C to 80°C (2 mmHg)
• Quantity: 5 g
• Refractive Index: 1.557
• UN Number: UN2206
• Beilstein: 2690768
• Formula Weight: 167.6
• Percent Purity: 97%
• Chemical Name or Material: 2-Chloro-6-methylphenyl isocyanate

Safety and Handling

Hazard Category	H315-H319-H330-H334-H335
Hazard Statement	GHS H Statement H330-H334-H315-H319-H335 Fatal if inhaled. May cause allergy or asthma symptoms or breathing difficulties if inhaled. Causes skin irritation. Causes serious eye irritation. May cause respiratory irritation.
Precautionary Statement	P260-P264b-P271-P280-P284-P285-P302+P352-P304+P340-P305+P351+P338-P310-P312-P332+P313-P362-P501c
DOTInformation	Transport Hazard Class: 6.1; Packing Group: II; Proper Shipping Name: ISOCYANATES, TOXIC, N.O.S.
TSCA	No
Recommended Storage	Keep cold

SDS

RUO – Research Use Only