AG003FW9

393-82-8 | 2,5-Bis(trifluoromethyl)benzoyl chloride

AG003FW9

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CAS Number	393-82-8
Catalog Number	AG003FW9(AGN-PC-0KK8S1)
Chemical Name	2,5-Bis(trifluoromethyl)benzoyl chloride
IUPAC Name	2,5-bis(trifluoromethyl)benzoyl chloride
InChI	InChI=1S/C9H3ClF6O/c10-7(17)5-3-4(8(11,12)13)1-2-6(5)9(14,15)16/h1-3H
InChI Key	LRJNPOCQOZWIGR-UHFFFAOYSA-N
MDL Number	MFCD00074997
Molecular Formula	C9H3ClF6O
Molecular Weight	276.5629
SMILES	O=C(Cl)C1=CC(C(F)(F)F)=CC=C1C(F)(F)F
Synonyms	2,5-Bis(trifluoromethyl)benzoyl chloride, 393-82-8, 2,5-bis-trifluoromethyl-benzoyl chloride, Benzoyl chloride,2,5-bis(trifluoromethyl)-, AC1MC7VP, AC1Q4J1I, SCHEMBL937701, CTK4I1314, DTXSID70372261, LRJNPOCQOZWIGR-UHFFFAOYSA-N, JRD-1676, ZINC2545319, ZX-AP001416, ACM393828, MFCD00074997, PC5976, SBB067917, AKOS005255778, AM61529, 2,5-Bis(trifluoromethyl)benzoylchloride, 2,5-Bis(trifluromethyl)benzoyl chloride, 2,5-bis-trifluoromethylbenzoyl chloride, AN-44690, PS-10712, DB-069806, B3980, Benzoyl chloride, 2,5-bis(trifluoromethyl)-, FT-0654730, 2,5-Bis(trifluoromethyl)benzoyl chloride, 97%, C-0060, 2,5-bis(trifluoromethyl)benzenecarbonyl chloride, 393B828, A824533, I01-5039, 2,5-Bis benzoylchloride, ZINC02545319, CID2737812,

Complexity	297
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	275.978g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	276.562g/mol
Monoisotopic Mass	275.978g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

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

Lot Number