AG002AGQ

20600-44-6 | 2(3H)-Benzothiazolone, 5-chloro-

AG002AGQ

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CAS Number	20600-44-6
Catalog Number	AG002AGQ(AGN-PC-0JTN0U)
Chemical Name	2(3H)-Benzothiazolone, 5-chloro-
IUPAC Name	5-chloro-3H-1,3-benzothiazol-2-one
InChI	InChI=1S/C7H4ClNOS/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,(H,9,10)
InChI Key	NOVHYVKPKWACML-UHFFFAOYSA-N
MDL Number	MFCD00060125
Molecular Formula	C7H4ClNOS
Molecular Weight	185.6308
SMILES	O=C1SC2=CC=C(Cl)C=C2N1
Synonyms	20600-44-6, 5-Chloro-2-benzothiazolinone, 5-chlorobenzo[d]thiazol-2(3H)-one, 5-CHLOROBENZOTHIAZOLONE, 5-Chloro-2(3H)-benzothiazolone, 2(3H)-Benzothiazolone, 5-chloro-, 5-chloro-3H-1,3-benzothiazol-2-one, 5-Chloro-2-benzothiazolone, Chlorobenzothiazolinone; 95%, CHEMBL2381489, NOVHYVKPKWACML-UHFFFAOYSA-N, 5-Chloro-1,3-benzothiazol-2(3H)-one, 2-Benzothiazolol, 5-chloro-, Chlorobenzothiazolinone, AC1LCOEN, PubChem13573, ACMC-209fce, 5-Chlorobenzothiazol-2-ol, KSC494O8T, 2-oxo-5-chlorobenzothiazoline, SCHEMBL507970, Jsp004222, 5-chloro-3H-benzothiazol-2-one, CTK3J4789, DTXSID50345337, 5-chloro-1,3-benzothiazol-2-ol, KS-00000ZP7, STR05612, ZINC2528031, ZX-AT007574, ANW-24156, BDBM50434116, FCH918278, MFCD00060125, AKOS006230208, CS-W016931, OR10944, PS-3378, RP17979, TRA0041981, VZ30253, ACM20600446, 5-Chloro-2-benzothiazolinone, AldrichCPR, AJ-38208, AK-34033, CC-21611, CJ-09003, SC-46605, U770, 5-Chloro-1,3-benzothiazol-2(3H)-one #, AX8004206, DB-029110, RT-002181, ST2406219, TL8006915, FT-0620238, 5-chloro-2,3-dihydro-1,3-benzothiazol-2-one, K-5990, 5-Chloro-2,3-dihydro-2-oxo-1,3-benzothiazole, C-07426, I14-4811, J-517387, C7H4ClNOS, c1137, CID603829, A4478, 5-Chloro-2(3H)-benzothiazolone, 98% - 100G 100g,

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	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number