AG003J81

65055-17-6 | 3-Chloro-4-fluorobenzoyl chloride

AG003J81

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CAS Number	65055-17-6
Catalog Number	AG003J81(AGN-PC-0KK7WI)
Chemical Name	3-Chloro-4-fluorobenzoyl chloride
IUPAC Name	3-chloro-4-fluorobenzoyl chloride
InChI	InChI=1S/C7H3Cl2FO/c8-5-3-4(7(9)11)1-2-6(5)10/h1-3H
InChI Key	DLZUHSFUBZTBQZ-UHFFFAOYSA-N
MDL Number	MFCD00236215
Molecular Formula	C7H3Cl2FO
Molecular Weight	193.0025
SMILES	ClC=1C=C(C(=O)Cl)C=CC1F
Synonyms	3-Chloro-4-fluorobenzoyl chloride, 65055-17-6, 4-fluoro-3-chlorobenzoyl chloride, 3-Chloro-4-fluoro benzoyl chloride, MFCD00236215, Benzoyl chloride, 3-chloro-4-fluoro-, AC1MC5TX, ACMC-209np6, DSSTox_CID_29301, DSSTox_RID_83419, DSSTox_GSID_49344, KSC622A8F, SCHEMBL193605, AC1Q4L54, CHEMBL3187775, DTXSID7049344, 3-chloro-4-fluorobenzoylchloride, CTK5C2082, DLZUHSFUBZTBQZ-UHFFFAOYSA-N, 3-chloro-4-fluoro-benzoyl chloride, 4-fluoro-3-chloro benzoyl chloride, JRD-0331, ZINC2560120, Tox21_202979, ANW-34984, Benzoyl chloride,3-chloro-4-fluoro-, SBB067892, WT1849, AKOS006230401, AS00038, JS-4105, VZ26617, 3-chloranyl-4-fluoranyl-benzoyl chloride, NCGC00260525-01, 3-Chloro-4-fluorobenzoyl chloride, 97%, AN-38667, CJ-09518, AB0020002, CAS-65055-17-6, TC-062419, FT-0615389, V0686, KS-00001110, 3-Chloro-4-fluorobenzoyl chloride, AldrichCPR, 65055-17-6 3-chloro-4-fluorobenzoyl chloride, A834956, I01-2337, ZINC02560120, CID2736548, C2122, Benzoyl chloride, 3-chloro-4-fluoro- (9CI), 3-Chloro-4-fluorobenzoyl chloride, 98% - 1G 1g,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.954g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	192.998g/mol
Monoisotopic Mass	191.954g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H227-H290-H314
Packing Group	Ⅱ
Precautionary statements	P210-P234-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P370+P378-P390-P403+P235-P405-P406-P501
UN Code	UN 3265

Certificate of Analysis

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