Phenethyl Isocyanate , >98.0%(GC) , 1943-82-4

CAS NO.：1943-82-4

Empirical Formula: C9H9NO

Molecular Weight: 147.17

MDL number: MFCD00037044

EINECS: 413-080-0

PRODUCT Properties

• Boiling point: 210 °C(lit.)
• Density: 1.063 g/mL at 25 °C(lit.)
• refractive index: n20/D 1.522(lit.)
• Flash point: 212 °F
• solubility: Chloroform, Ethyl Acetate (Slightly)
• form: Liquid
• Specific Gravity: 1.063
• color: Colorless to yellow
• Water Solubility: decomposes
• Stability: Moisture Sensitive
• InChI: InChI=1S/C9H9NO/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2
• InChIKey: HACRKYQRZABURO-UHFFFAOYSA-N
• SMILES: C1(CCN=C=O)=CC=CC=C1
• CAS DataBase Reference: 1943-82-4(CAS DataBase Reference)

Description and Uses

Phenethyl Isocyanate functions as a mechanism-based inhibitor of both rat and human cytochrome P 450 enzymes. It is also a useful reagent in the synthesis of novel sulfonamides derivatives with antimicrobial activities.

Safety

• Symbol(GHS): GHS05,GHS06,GHS08,GHS09
• Signal word: Danger
• Hazard statements: H302-H314-H317-H331-H334-H411
• Precautionary statements: P273-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338
• Hazard Codes: T,C,N
• Risk Statements: 22-23-35-42/43-51/53-25
• Safety Statements: 23-26-36/37/39-43-45-61-43A
• RIDADR: UN 2206 6.1/PG 3
• WGK Germany: 2
• Hazard Note: Toxic/Corrosive
• HazardClass: IRRITANT
• PackingGroup: III
• HS Code: 29291090
• Limited Quantities: 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
• Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)