AG008U2V

118526-19-5 | 5-Benzothiazolol,2-amino-(9CI)

AG008U2V

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CAS Number	118526-19-5
Catalog Number	AG008U2V(AGN-PC-000O68)
Chemical Name	5-Benzothiazolol,2-amino-(9CI)
IUPAC Name	2-amino-1,3-benzothiazol-5-ol
InChI	InChI=1S/C7H6N2OS/c8-7-9-5-3-4(10)1-2-6(5)11-7/h1-3,10H,(H2,8,9)
InChI Key	PIERIBXILPXPFL-UHFFFAOYSA-N
MDL Number	MFCD00985125
Molecular Formula	C7H6N2OS
Molecular Weight	166.2003
SMILES	OC1=CC=C(SC(N)=N2)C2=C1
Synonyms	2-AMINOBENZO[D]THIAZOL-5-OL, 118526-19-5, 2-Amino-1,3-benzothiazol-5-ol, 2-Amino-5-hydroxybenzothiazole, 5-Benzothiazolol, 2-amino-, 5-Benzothiazolol,2-amino-(9CI), 5-hydroxy-1,3-benzothiazol-2-amine, 2-Amino-5-hydroxy-1,3-benzothiazole, 2-amino-benzothiazol-5-ol, SCHEMBL72699, BEN786, CTK8B6654, DTXSID30557198, PIERIBXILPXPFL-UHFFFAOYSA-N, ANW-53897, MFCD00985125, ZINC34245836, AKOS006280745, CA-2014, PS-3998, RP02477, SB18594, WT82543, KS-00002A31, AJ-87624, DA-19244, SC-53518, RT-007343, CS-0052049, FT-0730995, ST24027763, Y5222, C-1274, 526A195, W-204981, F2167-4054, C7H6N2OS, 2-AMINO-5-(HYDROXYMETHYL)THIAZOLE,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.02g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	166.198g/mol
Monoisotopic Mass	166.02g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	87.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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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