AG003K6U

876-08-4 | 4-(Chloromethyl)benzoyl chloride

AG003K6U

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CAS Number	876-08-4
Catalog Number	AG003K6U(AGN-PC-0JL9HP)
Chemical Name	4-(Chloromethyl)benzoyl chloride
EC Number	212-881-0
IUPAC Name	4-(chloromethyl)benzoyl chloride
InChI	InChI=1S/C8H6Cl2O/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,5H2
InChI Key	RCOVTJVRTZGSBP-UHFFFAOYSA-N
MDL Number	MFCD00053224
Molecular Formula	C8H6Cl2O
Molecular Weight	189.0386
NSC Number	508741
SMILES	C(=O)(Cl)c1ccc(cc1)CCl
Synonyms	4-(Chloromethyl)benzoyl chloride, 876-08-4, 4-chloromethylbenzoyl chloride, Benzoyl chloride, 4-(chloromethyl)-, 4-(Chloromethyl)benzoylchloride, 4-ChloroMethyl-Benzoyl Chloride, RCOVTJVRTZGSBP-UHFFFAOYSA-N, 4-(Chloromethyl)benzoyl chloride, 97%, 4-chloromethylbenzoylchloride, 4-chloromethyl benzoyl chloride, EINECS 212-881-0, NSC508741, ACMC-209qop, AC1L2DFH, 4-chlormethylbenzoylchloride, AC1Q3U1D, AC1Q3U8M, 4-(chlormethyl)benzoylchlorid, p-chloromethylbenzoyl chloride, 4-chloromethyl-benzoylchloride, KSC491C5T, SCHEMBL186794, p-chloromethyl benzoyl chloride, CTK3J1159, KS-00000WOD, DTXSID20236501, 4-(chloromethyl) benzoyl chloride, 4-(chloromethyl)-benzoyl chloride, Benzoyl chloride,4-(chloromethyl)-, ZINC1603192, ANW-38855, MFCD00053224, SBB067919, 4-(chloromethyl)benzoic acid chloride, AKOS005255638, NSC-508741, RL05458, RTR-027543, TRA0005979, AN-47890, AS-15671, CJ-25811, Q212, SC-18139, 4-(chloromethyl)-1-benzenecarbonyl chloride, AB0017457, AB1002413, DB-031940, TR-027543, FT-0084428, FT-0618225, I01-5092, W-104011, null, C8H6Cl2O, 4- BENZOYLCHLORIDE, C8-H6-Cl2-O, CID70136, AR-1F6785, c1283, 4-Chloromethylbenzoyl chloride, 98% - 100G 100g, 93710-27-1,

Complexity	139
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.98g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	189.035g/mol
Monoisotopic Mass	187.98g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H290-H314-H335
Packing Group	Ⅱ
Precautionary statements	P261-P280-P305+P351+P338-P310-P234-P260-P264-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P390-P405-P406-P501
UN Code	UN 3261

Certificate of Analysis

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