AG003IAS

2251-65-2 | 3-(Trifluoromethyl)benzoyl chloride

AG003IAS

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CAS Number	2251-65-2
Catalog Number	AG003IAS(AGN-PC-0JLP8M)
Chemical Name	3-(Trifluoromethyl)benzoyl chloride
EC Number	218-844-5
IUPAC Name	3-(trifluoromethyl)benzoyl chloride
InChI	InChI=1S/C8H4ClF3O/c9-7(13)5-2-1-3-6(4-5)8(10,11)12/h1-4H
InChI Key	RUJYJCANMOTJMO-UHFFFAOYSA-N
MDL Number	MFCD00000680
Molecular Formula	C8H4ClF3O
Molecular Weight	208.5650
NSC Number	88307
SMILES	O=C(c1cccc(c1)C(F)(F)F)Cl
Synonyms	3-(Trifluoromethyl)benzoyl chloride, 2251-65-2, Benzoyl chloride, 3-(trifluoromethyl)-, m-(Trifluoromethyl)benzoyl chloride, alpha,alpha,alpha-Trifluoro-m-toluoyl chloride, m-Trifluoromethylbenzoyl chloride, 3-trifluoromethylbenzoyl chloride, MFCD00000680, 3-(trifluoromethyl)benzoylchloride, 3-Trifluoromethyl-benzoyl chloride, RUJYJCANMOTJMO-UHFFFAOYSA-N, 3-(trifluoromethyl) benzoyl chloride, 3-(Trifluoromethyl)benzoyl chloride, 98%, alpha,alpha,alpha-Trifluoro-m-tolyl Chloride, EINECS 218-844-5, NSC 88307, PubChem5468, MTF-BOC, AC1L2ODL, AC1Q4JRA, Intermediates-ZCF02602, ACMC-209fx0, AC1Q4J6N, m-Toluoyl chloride, alpha,alpha,alpha-trifluoro-, SCHEMBL19310, KSC203K5D, 3-trifluoromethylbenzoylchloride, DTXSID2062294, CTK1A3551, KS-00000AWG, RUJYJCANMOTJMO-UHFFFAOYSA-, TIMTEC-BB SBB006693, m-trifluoromethyl benzoyl chloride, m-trifluoromethyl-benzoyl chloride, 3-tri-fluoromethylbenzoyl chloride, 3-trifluoromethyl benzoyl chloride, 3-(Chlorocarbonyl)benzotrifluoride, LABOTEST-BB LTBB005353, a,a,a-Trifluoro-m-toluoyl chloride, 3-(trifiuoromethyl)benzoyl chloride, ACT12087, JRD-0071, NSC88307, ZINC1841347, 3-(trifluoromethyl)-benzoyl chloride, ANW-24898, LABOTEST-BB LT03379715, NSC-88307, SBB006693, AKOS009156910, AM61431, AS01916, CM12893, MCULE-9412073526, RTC-062423, TRA0033730, VZ26155, 3-(trifluoromethyl)benzoic acid chloride, AC-25993, AN-50613, BP-13007, CJ-07113, CJ-30005, PS-10748, Q018, SC-02603, 3-(TRIFLUOROMETHYL)BENZYOL CHLORIDE, DB-021772, TC-062423, TL8001888, FT-0613934, ST51039945, .alpha.,.alpha.-Trifluoro-m-toluoyl chloride, 3-(trifluoromethyl)-1-benzenecarbonyl chloride, m-Toluoyl chloride,.alpha.,.alpha.-trifluoro-, Y-8818, I01-0655, W-107469, .alpha.,.alpha.,.alpha.-Trifluoro-m-toluoyl chloride, F2190-0082, m-Toluoyl chloride, .alpha.,.alpha.,.alpha.-trifluoro-, InChI=1/C8H4ClF3O/c9-7(13)5-2-1-3-6(4-5)8(10,11)12/h1-4H, 3- benzoylchloride, C8H4ClF3O, C8-H4-Cl-F3-O, 3-(trifluoromethyl) benzoyl chlorid, CID75257, AR-1J3619, T1335, 3-(Trifluoromethyl)benzoyl chloride, 98% - 100G 100g, 23046-03-9,

Complexity	202
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.99g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	208.564g/mol
Monoisotopic Mass	207.99g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅱ
Precautionary statements	P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P363-P405-P501
UN Code	UN 3265

Certificate of Analysis

Lot Number