3-Bromobenzotrifluoride , 98% , 401-78-5

Synonym(s):
1-Bromo-3-(trifluoromethyl)benzene;3-Bromo-α,α,α-trifluorotoluene

CAS NO.：401-78-5

Empirical Formula: C7H4BrF3

Molecular Weight: 225.01

MDL number: MFCD00000380

EINECS: 206-932-6

PRODUCT Properties

• Melting point: 1°C
• Boiling point: 151-152 °C(lit.)
• Density: 1.613 g/mL at 25 °C(lit.)
• refractive index: n20/D 1.473(lit.)
• Flash point: 110 °F
• storage temp.: Sealed in dry,Room Temperature
• form: Liquid
• color: Clear colorless to slightly yellow
• Specific Gravity: 1.613
• BRN: 1449557
• InChI: InChI=1S/C7H4BrF3/c8-6-3-1-2-5(4-6)7(9,10)11/h1-4H
• InChIKey: NNMBNYHMJRJUBC-UHFFFAOYSA-N
• SMILES: C1(Br)=CC=CC(C(F)(F)F)=C1
• CAS DataBase Reference: 401-78-5(CAS DataBase Reference)
• NIST Chemistry Reference: Benzene, 1-bromo-3-(trifluoromethyl)-(401-78-5)
• EPA Substance Registry System: 3-Bromobenzotrifluoride (401-78-5)

Description and Uses

1-Bromo-3-(trifluoromethyl)benzene is used in the synthesis of calcium channel inhibitors for inflammatory and neuropathic pain.

Safety

• Symbol(GHS): GHS02
• Signal word: Warning
• Hazard statements: H226
• Precautionary statements: P210
• Hazard Codes: Xi,F
• Risk Statements: 10-36/37/38
• Safety Statements: 23-24/25-37/39-26-16-36
• RIDADR: UN 1993 3/PG 3
• WGK Germany: 3
• RTECS: XS7970000
• Hazard Note: Flammable
• TSCA: Yes
• HazardClass: 3
• PackingGroup: III
• HS Code: 29036990
• Limited Quantities: 5.0 L (1.3 gallons) (liquid)
• Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)