AG000TUV

130-03-0 | 2H-1-benzothiophen-3-one

AG000TUV

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CAS Number	130-03-0
Catalog Number	AG000TUV(AGN-PC-0NDZ8O)
Chemical Name	2H-1-benzothiophen-3-one
IUPAC Name	1-benzothiophen-3-one
InChI	InChI=1S/C8H6OS/c9-7-5-10-8-4-2-1-3-6(7)8/h1-4H,5H2
InChI Key	ADHAJDDBRUOZHJ-UHFFFAOYSA-N
MDL Number	MFCD08061607
Molecular Formula	C8H6OS
Molecular Weight	150.1976
SMILES	O=C1C2=CC=CC=C2SC1
Synonyms	Benzo[b]thiophen-3(2H)-one, 130-03-0, 1-BENZOTHIOPHEN-3(2H)-ONE, 2,3-dihydro-1-benzothiophen-3-one, Benzothiophen-3-one, 2H-1-benzothiophen-3-one, Benzo(b)thiophen-3(2H)-one, PubChem23797, benzo[b]thiophen-3-one, SCHEMBL69404, SCHEMBL4778774, CTK0I1132, DTXSID70450750, ADHAJDDBRUOZHJ-UHFFFAOYSA-N, ANW-52258, ZINC89223552, AKOS006280949, CS-W003457, FS-2956, GS-4488, MCULE-2970806780, RP21394, AK-29817, BR-29817, CJ-22544, SY030591, AB0035426, AJ-128496, DB-062721, ST2412647, TR-004104, 4CH-014471, AM20020379, FT-0647985, X9761, MFCD08061607 (95%), S-6158, 138992-EP2272849A1, 138992-EP2292586A2, J-504227, F0211-0053, C8H6OS, CID10986413, Benzo[b]thien-2(3H)-ylidene, 3-oxo- (9CI), 137092-69-4,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.014g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	150.195g/mol
Monoisotopic Mass	150.014g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	42.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H332-H335
Precuationary statements	P261-P280-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number