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4-(Trifluoromethyl)benzoyl Chloride

Catalog Number
ACM329157
Product Name
4-(Trifluoromethyl)benzoyl Chloride
Structure
CAS
329-15-7
Category
Liquid Crystal (LC) Building Blocks
Synonyms
α,α,α-Trifluoro-p-toluoyl Chloride
IUPAC Name
4-(trifluoromethyl)benzoyl chloride
Molecular Weight
208.56
Molecular Formula
C8H4ClF3O
Canonical SMILES
C1=CC(=CC=C1C(=O)Cl)C(F)(F)F
InChI
InChI=1S/C8H4ClF3O/c9-7(13)5-1-3-6(4-2-5)8(10,11)12/h1-4H
InChI Key
OXZYBOLWRXENKT-UHFFFAOYSA-N
Boiling Point
68 °C/12 mmHg
Purity
>97.0%(GC)
Density
Moisture Sensitive
Appearance
Colorless to Almost colorless clear liquid
Storage
Store under inert gas
Complexity
194
Covalently-Bonded Unit Count
1
EC Number
206-342-9
Exact Mass
207.990277g/mol
Formal Charge
0
Hazard Statements
H314 : Causes severe skin burns and eye damage.H227 : Combustible liquid.H290 : May be corrosive to metals.
Heavy Atom Count
13
MDL Number
MFCD00000694
Monoisotopic Mass
207.990277g/mol
NSC Number
88292
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P210 : Keep away from heat/sparks/open flames/hot surfaces. No smoking.P234 : Keep only in original container.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ protective clothing/ eye protection/ face protection.P370 + P378 : In case of fire: Use dry sand, dry chemical or alcohol-resistant foam to extinguish.P390 : Absorb spillage to prevent material damage.P303 + P361 + P353 : IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water/shower.P301 + P330 + P331 : IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.P363 : Wash contaminated clothing before reuse.P304 + P340 + P310 : IF INHALED: Remove person to fresh air and keep comfortable for breathing. Immediately call a POISON CENTER/doctor.P305 + P351 + P338 + P310 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. Immediately call a POISON CENTER/doctor.P403 + P235 : Store in a well-ventilated place. Keep cool.P406 : Store in corrosive resistant container with a resistant inner liner.P405 : Store locked up.
Refractive Index
1.48
Rotatable Bond Count
1
Signal Word
Danger
Specific Gravity
1.41
XLogP3
4.1
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