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4-(Trifluoromethoxy)benzoyl Chloride

Catalog Number
ACM36823888
CAS Number
36823-88-8
Product Name
4-(Trifluoromethoxy)benzoyl Chloride
Structure
Category
Liquid Crystal (LC) Building Blocks; Liquid Crystal (LC) Materials
IUPAC Name
4-(trifluoromethoxy)benzoyl chloride
Molecular Weight
224.56
Molecular Formula
C8H4ClF3O2
Canonical SMILES
C1=CC(=CC=C1C(=O)Cl)OC(F)(F)F
InChI
InChI=1S/C8H4ClF3O2/c9-7(13)5-1-3-6(4-2-5)14-8(10,11)12/h1-4H
InChI Key
ZXKKOFJYPRJFIE-UHFFFAOYSA-N
Boiling Point
56 °C/2 mmHg
Purity
>98.0%(GC)(T)
Density
Moisture Sensitive
Appearance
Colorless to Almost colorless clear liquid
Storage
Store under inert gas
Complexity
209
Covalently-Bonded Unit Count
1
Exact Mass
223.985192g/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
14
MDL Number
MFCD00052329
Monoisotopic Mass
223.985192g/mol
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
1.47
Rotatable Bond Count
2
Signal Word
Danger
Specific Gravity
1.43
XLogP3
3.6
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