AG003LDV

67515-56-4 | 4-Fluoro-3-(trifluoromethyl)benzoyl chloride

AG003LDV

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CAS Number	67515-56-4
Catalog Number	AG003LDV(AGN-PC-0JMTSA)
Chemical Name	4-Fluoro-3-(trifluoromethyl)benzoyl chloride
IUPAC Name	4-fluoro-3-(trifluoromethyl)benzoyl chloride
InChI	InChI=1S/C8H3ClF4O/c9-7(14)4-1-2-6(10)5(3-4)8(11,12)13/h1-3H
InChI Key	BUDISZQHCHGLJW-UHFFFAOYSA-N
MDL Number	MFCD00061159
Molecular Formula	C8H3ClF4O
Molecular Weight	226.5554
SMILES	O=C(Cl)C1=CC=C(F)C(C(F)(F)F)=C1
Synonyms	4-Fluoro-3-(trifluoromethyl)benzoyl chloride, 67515-56-4, 4-fluoro-3-(trifluoromethyl)benzoylchloride, BUDISZQHCHGLJW-UHFFFAOYSA-N, alpha,alpha,alpha,4-Tetrafluoro-m-toluoyl Chloride, MFCD00061159, 4-fluoro-3-trifluoromethyl-benzoyl chloride, Benzoyl chloride,4-fluoro-3-(trifluoromethyl)-, Benzoyl chloride, 4-fluoro-3-(trifluoromethyl)-, AC1L3OTR, 4-Fluoro-3-(trifluoromethyl)benzoul chloride, ACMC-1B7WD, AC1Q4KZ4, SCHEMBL759728, CTK5C6275, DTXSID40217857, JRD-0354, ZINC2600079, KM1111, SBB097007, AKOS009158608, AM61646, AS00071, TRA0071456, VZ29015, KS-000015S1, PS-10739, 4-fluoro-3-trifluoromethylbenzoyl chloride, 4-Fluoro-5-trifluoromethylbenzoyl chloride, 4-Fluoro-3-trifluoromethyl benzoyl chloride, 5-(Chlorocarbonyl)-2-fluorobenzotrifluoride, AB0030660, TC-062453, F0659, FT-0618471, X2872, 4-fluoranyl-3-(trifluoromethyl)benzoyl chloride, A835784, 4-Fluoro-3-(trifluoromethyl)benzoyl chloride, 98%, 4 - Fluoro - 3 - (trifluoromethyl)benzoyl chloride, I01-15084, 4-FLUORO-3- BENZOYLCHLORIDE, CID144253, ZINC02600079, 4-Fluoro-3-(trifluoromethyl)benzoyl chloride, 97% - 1G 1g,

Complexity	228
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	225.981g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	226.555g/mol
Monoisotopic Mass	225.981g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅱ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 3265

Certificate of Analysis

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