AG003JAE

21815-91-8 | 3-Chlorobenzo[b]thiophene-2-carbonyl chloride

AG003JAE

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CAS Number	21815-91-8
Catalog Number	AG003JAE(AGN-PC-0JS95K)
Chemical Name	3-Chlorobenzo[b]thiophene-2-carbonyl chloride
IUPAC Name	3-chloro-1-benzothiophene-2-carbonyl chloride
InChI	InChI=1S/C9H4Cl2OS/c10-7-5-3-1-2-4-6(5)13-8(7)9(11)12/h1-4H
InChI Key	GWKSSMDJEWPKCM-UHFFFAOYSA-N
MDL Number	MFCD00053069
Molecular Formula	C9H4Cl2OS
Molecular Weight	231.0985
SMILES	O=C(Cl)C1=C(Cl)C2=CC=CC=C2S1
Synonyms	3-Chlorobenzo[b]thiophene-2-carbonyl chloride, 21815-91-8, 3-Chloro-1-benzothiophene-2-carbonyl chloride, 3-Chlorobenzothiophene-2-carbonyl chloride, 3-chloro-benzo[b]thiophene-2-carbonyl chloride, 3-chlorobenzo[b]thiophen-2-carbonyl chloride, GWKSSMDJEWPKCM-UHFFFAOYSA-N, MFCD00053069, EC-000.1740, Benzo[b]thiophene-2-carbonylchloride, 3-chloro-, Benzo[b]thiophene-2-carbonyl chloride, 3-chloro-, 3-Chlorobenzo[b]-2-thiophenecarboxylic acid chloride, AC1LATAT, ACMC-1CNE6, AC1Q3G4T, SCHEMBL64428, 3-CHLOROBENZO[B]THIOPHENE-2-CARBONYLCHLORIDE, ARONIS019384, CTK1A1660, KS-00004BCO, DTXSID70334187, ACT07955, ALBB-010796, KS-000014IZ, ZINC2169340, ANW-24591, BBL014254, GEO-00658, SBB028608, STK084643, AKOS000281416, MCULE-5071823548, RP05547, TRA0051817, VT20216, AJ-33971, AS-32704, 2-chlorocarbonyl-3-chlorobenzo[b]thiophene, UPCMLD0ENAT0510-6078:001, 3-Chlorobenzo thiophene-2-carbonyl chloride, 3-chlorobenzo[b]thiophene carbonyl chloride, 3chlorobenzo[b]thiophen-2-carbonyl chloride, AB0040649, DB-014267, TC-113336, 3-chlorobenzo-[b]thiophene carbonyl chloride, 4CH-022979, BB 0245713, FT-0615462, R1844, ST24042087, ST45033230, Y8287, 3-chlorobenzo-[b]thiophene-2-carbonyl chloride, 3-chlorobenzo[b]-thiophene-2-carbonyl chloride, 3-chloranyl-1-benzothiophene-2-carbonyl chloride, 3-Chloro-1-benzothiophene-2-carbonyl chloride #, 3-Chloro-benzo[b]thiophene-2-carbonyl chloride, 3 - Chlorobenzothiophene - 2 - carbonyl chloride, 3-chloro-1-benzo[b]thiophene-2-carbonyl chloride, A815679, 3-Chlorobenzo[b]thiophene-2-carbonyl chloride, 97%, 3-Chlorobenzo[b]thiophene-2-carboxylic acid chloride, W-200226, 3-chloro-benzo[b]thiophene-2-carboxylic acid chloride, I14-16048, F3146-2492, CID519898, C2286, 3-Chlorobenzothiophene-2-carbonyl chloride, 97% - 1G 1g,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.936g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	231.09g/mol
Monoisotopic Mass	229.936g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.4

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 3261

Certificate of Analysis

Lot Number