AG0026GS

17890-56-1 | Benzo[b]thiophen-2-ylmethanol

AG0026GS

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CAS Number	17890-56-1
Catalog Number	AG0026GS(AGN-PC-0KKXGJ)
Chemical Name	Benzo[b]thiophen-2-ylmethanol
IUPAC Name	1-benzothiophen-2-ylmethanol
InChI	InChI=1S/C9H8OS/c10-6-8-5-7-3-1-2-4-9(7)11-8/h1-5,10H,6H2
InChI Key	SUHKSQTXXZQEBH-UHFFFAOYSA-N
MDL Number	MFCD02682004
Molecular Formula	C9H8OS
Molecular Weight	164.2242
SMILES	OCC1=CC2=CC=CC=C2S1
Synonyms	17890-56-1, 2-(Hydroxymethyl)benzo[b]thiophene, benzo[b]thiophene-2-methanol, Benzo[b]thiophen-2-ylmethanol, 1-benzothiophen-2-ylmethanol, Benzo[b]thiophen-2-yl-methanol, (1-Benzothiophen-2-yl)methanol, 1-benzothien-2-ylmethanol, 2-(hydroxymethyl)benzothiophene, CHEMBL3358209, MFCD02682004, Benzothiophen-2-methanol, AC1MCQW5, hydroxymethylbenzothiophene, Benzothiophene-2-methanol, ACMC-1BOV5, benzo[b]thiophen-yl-methanol, KSC173S6L, 1-benzothiophene-2-ylmethanol, SCHEMBL355949, Benzothiophene-2-methanol, 97%, CTK0H3965, DTXSID10379996, SUHKSQTXXZQEBH-UHFFFAOYSA-N, benzo[b]thiophen-2-ylmethan-1-ol, ZINC158706, STR07503, ANW-59561, BDBM50037886, SBB087818, AKOS000278998, CB-2500, CS-W017901, FS-1500, RP02380, TRA0073291, VT20071, KS-0000090V, AC-28053, AJ-15319, AK-48826, AM803383, CJ-01815, SC-46532, SY021579, ZB007036, AB0040424, AB1008633, DB-002643, RT-002025, 4CH-021648, B4628, FT-0607369, ST24046028, Y8026, Z-4630, MFCD02682004 (97+%), 890H561, A812405, W-206258, I14-14275, Z1741962760, 2-(Hydroxymethyl)benzo[b]thiophene; Benzo[b]thiophen-2-yl-methanol, Benzoic Acid Ethyl Ester, C9H8OS, ZINC00158706, CID2776335, Benzothiophene-2-methanol, 98% - 1G 1g, 102113-98-4,

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.03g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.222g/mol
Monoisotopic Mass	164.03g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	48.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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