AG00BXBK

39205-62-4 | 4-CHORO-2(3H)-BENZOTHIAZOLONE

AG00BXBK

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CAS Number	39205-62-4
Catalog Number	AG00BXBK(AGN-PC-0JM0PM)
Chemical Name	4-CHORO-2(3H)-BENZOTHIAZOLONE
EC Number	254-354-8
IUPAC Name	4-chloro-3H-1,3-benzothiazol-2-one
InChI	InChI=1S/C7H4ClNOS/c8-4-2-1-3-5-6(4)9-7(10)11-5/h1-3H,(H,9,10)
InChI Key	MBFOZAKOORJAMK-UHFFFAOYSA-N
MDL Number	MFCD00796306
Molecular Formula	C7H4ClNOS
Molecular Weight	185.6308
SMILES	O=C2SC1=CC=CC(Cl)=C1N2
Synonyms	39205-62-4, 4-Chlorobenzo[d]thiazol-2(3H)-one, 2-Hydroxy-4-chloro benzothiozole, 4-Choro-2(3H)-benzothiazolone, 4-Chlorobenzothiazol-2(3H)-one, 4-Chloro-2(3H)-benzothiazolone, 2-benzothiazolol, 4-chloro-, 2(3H)-Benzothiazolone, 4-chloro-, 4-chloro-2,3-dihydro-1,3-benzothiazol-2-one, 4-chloro-1,3-benzothiazol-2-ol, AK-87093, EINECS 254-354-8, PubChem21835, AC1L3SBU, AC1Q3KGZ, AC1Q3RSJ, 4-Chloro-benzothiazol-2-ol, 4-chloro-2-benzothiazolinone, SCHEMBL3420151, CHEMBL1650264, CTK4I1098, CTK8D6670, 2-Hydroxy-4-chloro benzothiazole, 4-Chloro-3H-benzothiazol-2-one, DTXSID40192458, MBFOZAKOORJAMK-UHFFFAOYSA-N, ZINC408034, 2(3H)-Benzothiazolone,4-chloro-, 4-Chloro-benzothiazol-2(3H)-one, 4-chloro-2-hydroxybenzo[d]thiazole, BCP28047, EBD39451, KS-000010CQ, ANW-58184, FCH926097, MFCD00796306, AKOS006337099, AKOS015960707, 4-chloro-3H-1,3-benzothiazol-2-one, MCULE-3530678083, VZ28838, 4-Chloro-benzo[d]-thiazol-2(3H)-one, ACM39205624, AC-12081, AJ-22638, BC204014, DS-18275, S778, AB0106542, AX8004205, TC-146929, 4CH-021502, CS-0030555, FT-0639533, ST24043646, Z-9182, Z-9186, 205H624, I14-4823, W-110920, 4-chlorobenzothiazolone, C7H4ClNOS, N,N'-Dimethylclonidine, 4-chlorobenzothiazol-2-one, C7-H4-Cl-N-O-S, C11H13Cl2N3, C11-H13-Cl2-N3, CID94494, AR-1D9052, 2(3H)-Benzothiazolone, 4-chloro- (9CI), 4-Chloro-benzo[d]-thiazol-2(3H)-one, 97% - 1G 1g, 41061-97-6, Benzenamine, 2,6-dichloro-N-(1,3-dimethyl-2-imidazolidinylidene)-,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.97g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	185.625g/mol
Monoisotopic Mass	184.97g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	54.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number