AG00BXM9

37859-42-0 | 2-Hydroxymethylbenzothiazole

AG00BXM9

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CAS Number	37859-42-0
Catalog Number	AG00BXM9(AGN-PC-0JO0VU)
Chemical Name	2-Hydroxymethylbenzothiazole
IUPAC Name	1,3-benzothiazol-2-ylmethanol
InChI	InChI=1S/C8H7NOS/c10-5-8-9-6-3-1-2-4-7(6)11-8/h1-4,10H,5H2
InChI Key	PQXMQZYDBQBWNL-UHFFFAOYSA-N
MDL Number	MFCD00226293
Molecular Formula	C8H7NOS
Molecular Weight	165.2123
NSC Number	108227
SMILES	OCC1=NC2=CC=CC=C2S1
Synonyms	37859-42-0, 1,3-Benzothiazol-2-ylmethanol, Benzo[d]thiazol-2-ylmethanol, 2-Benzothiazolemethanol, 2-Hydroxymethylbenzothiazole, 2-(Hydroxymethyl)benzothiazole, MFCD00226293, Benzothiazol-2-yl-methanol, 1,3-Benzothiazol-2-Yl-Methanol, PQXMQZYDBQBWNL-UHFFFAOYSA-N, benzothiazol-2-ylmethan-1-ol, benzothiazol-2-ylmethanol, NSC108227, zlchem 107, PubChem14535, AC1L6JL1, AC1Q4W8U, CHEMBL71700, SCHEMBL244157, AC1Q7C55, AC1Q7C57, IFLab1_002000, CTK1C2261, DTXSID30296191, ZLB0096, (1,3-benzothiazol-2-yl)methanol, 1,3-Benzothiazol-2-ylmethanol #, HMS1417K20, ZINC158625, 2-Hydroxymethylbenzothiazole, 98%, ACT02343, ALBB-024035, KS-00002A4S, ANW-46330, GEO-01525, SBB003908, STK950846, 2-(Hydroxymethyl)-1,3-benzothiazole, 2-(Hydroxymethyl)benzothiazole, 97%, AKOS000122014, MCULE-3257839986, NSC-108227, PS-4261, SDCCGMLS-0065936.P001, VZ20522, NCGC00334571-01, AJ-15265, SC-17147, SY096627, ZB006980, 1,3-Benzothiazol-2-ylmethanol, AldrichCPR, AB0115909, ST2406650, TC-135075, TL8002783, FT-0612624, R2680, ST45007663, EN300-03166, MFCD00226293 (97%), AB00627822-04, 859B420, A823905, S09-0067, W-200335, F0472-0232, Benzo-1,3-thiazol-2-ylmethanol, 2-Benzothiazolemethanol (6CI,9CI), AR-1D9044, CID268122, 3813-13-6,

Complexity	142
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	165.025g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	165.21g/mol
Monoisotopic Mass	165.025g/mol
Rotatable Bond Count	1
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
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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