AG002YBZ

2942-10-1 | Benzothiazole, 6-chloro-

AG002YBZ

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CAS Number	2942-10-1
Catalog Number	AG002YBZ(AGN-PC-0JQ9VQ)
Chemical Name	Benzothiazole, 6-chloro-
IUPAC Name	6-chloro-1,3-benzothiazole
InChI	InChI=1S/C7H4ClNS/c8-5-1-2-6-7(3-5)10-4-9-6/h1-4H
InChI Key	AIBQGOMAISTKSR-UHFFFAOYSA-N
MDL Number	MFCD01325561
Molecular Formula	C7H4ClNS
Molecular Weight	169.6314
NSC Number	522957
SMILES	ClC1=CC2=C(C=C1)N=CS2
Synonyms	6-Chlorobenzo[d]thiazole, 2942-10-1, 6-Chlorobenzothiazole, 6-chloro-1,3-benzothiazole, 6-Chloro Benzothiazole, Benzothiazole,6-chloro-, AK-59706, NSC522957, AC1L6YY2, SCHEMBL593507, CTK4G3277, BENZOTHIAZOLE, 6-CHLORO-, DTXSID60326036, ACT12127, KS-00000F8L, ZINC1605362, FCH843425, MFCD01325561, AKOS006276178, AB09074, CC-1287, CS-W006942, NSC-522957, AJ-28109, BC274637, CJ-25862, DS-16344, SC-33162, AB1007881, AX8105366, DB-029269, ST2406473, 4CH-017269, FT-0688531, InChI=1/C7H4ClNS/c8-5-1-2-6-7(3-5)10-4-9-6/h1-4, CID351738, ACN-049069, 6-Chlorobenzo[d]thiazole, 97% - 10MG 10mg, Benzothiazole, 6-chloro- (6CI,7CI,8CI,9CI),

Complexity	131
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.975g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	169.626g/mol
Monoisotopic Mass	168.975g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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