AG007N2P

13599-84-3 | 6-Hydroxybenzothiazole

AG007N2P

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CAS Number	13599-84-3
Catalog Number	AG007N2P(AGN-PC-0JPIJK)
Chemical Name	6-Hydroxybenzothiazole
IUPAC Name	1,3-benzothiazol-6-ol
InChI	InChI=1S/C7H5NOS/c9-5-1-2-6-7(3-5)10-4-8-6/h1-4,9H
InChI Key	ORIIXCOYEOIFSN-UHFFFAOYSA-N
MDL Number	MFCD00057883
Molecular Formula	C7H5NOS
Molecular Weight	151.1857
SMILES	C1=C(O)C=CC2=C1SC=N2
Synonyms	6-hydroxybenzothiazole, 6-Hydroxybenzothiazole, 13599-84-3, benzo[d]thiazol-6-ol, 6-Benzothiazolol, 1,3-benzothiazol-6-ol, benzothiazol-6-ol, 6-Benzothiazolol(7CI,8CI,9CI), 6-hydroxy-benzothiazole, SCHEMBL23069, KSC178S0N, CTK0H8906, DTXSID50159613, ORIIXCOYEOIFSN-UHFFFAOYSA-N, ZINC337916, AC1L4739, KS-00000FD4, ANW-50677, CH-553, MFCD00057883, SBB086783, AKOS006275129, CS-W000059, FS-3284, RP21502, AJ-19883, AK-23865, BR-23865, CJ-02977, SC-85270, AB0035562, ST2412411, TR-004835, 4CH-006791, FT-0645182, X9934, S-3704, A807013, AR-009/42290057, J-518792, InChI=1/C7H5NOS/c9-5-1-2-6-7(3-5)10-4-8-6/h1-4,9, C7H5NOS, C7-H5-N-O-S, CID151811, H1380,

Complexity	131
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	151.009g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	151.183g/mol
Monoisotopic Mass	151.009g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	61.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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