AG00C0GU

3541-37-5 | BENZO[B]THIOPHENE-2-CARBOXALDEHYDE

AG00C0GU

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CAS Number	3541-37-5
Catalog Number	AG00C0GU(AGN-PC-0JVOED)
Chemical Name	BENZO[B]THIOPHENE-2-CARBOXALDEHYDE
IUPAC Name	1-benzothiophene-2-carbaldehyde
InChI	InChI=1S/C9H6OS/c10-6-8-5-7-3-1-2-4-9(7)11-8/h1-6H
InChI Key	NXSVNPSWARVMAY-UHFFFAOYSA-N
MDL Number	MFCD01075041
Molecular Formula	C9H6OS
Molecular Weight	162.2083
SMILES	S1C(=CC2=C1C=CC=C2)C=O
Synonyms	Benzo[b]thiophene-2-carboxaldehyde, 3541-37-5, 1-benzothiophene-2-carbaldehyde, benzo[b]thiophene-2-carbaldehyde, 2-Formylbenzo[b]thiophene, Thianaphthene-2-carboxaldehyde, benzothiophene-2-carboxaldehyde, CHEMBL3358202, MFCD01075041, ACMC-209igo, AC1LEI9I, AC1Q6QFL, 2-benzothiophenecarbaldehyde, 2-formyl-benzo[b]thiophene, benzothiophene-2-carbaldehyde, SCHEMBL56884, 2-benzothiophenecarboxaldehyde, benzo[b]thiophene-2-aldehyde, KSC221S5L, Benzothiophen-2-carboxaldehyde, benzo[b]thiophen-2-carbaldehyde, CTK1C1955, KS-00000FOW, 1-benzothiophene-2-carboxaldehyde, DTXSID00353043, NXSVNPSWARVMAY-UHFFFAOYSA-N, ZINC158704, ALBB-026951, ANW-28198, BDBM50037716, GEO-00293, SBB068480, STL426235, AKOS004123260, CB-2498, CS-W007442, MCULE-6554635961, PS-6016, RP02259, RP22533, RTR-014647, AJ-15318, AK-42941, Benzo[b]thiophene-2-carboxaldehyde, 97%, BR-42941, CJ-01814, SC-27762, SY019968, ZB007035, AB0002498, AB1003909, DB-007272, TR-014647, AM20050576, B3777, FT-0082418, FT-0600559, ST24030117, ST50824822, W5705, C-1287, 82924-EP2298758A1, 82924-EP2298759A1, 82924-EP2305664A1, MFCD01075041 (97+%), 541B375, A822779, I14-7162, W-200321, Thianaphthene-2-carboxaldehyde; 2-Formylbenzo[b]thiophene, C9H6OS, ?Benzo[b]thiophene-2-carboxaldehyde, AR-1C1627, CID736500, ZINC00158704, Benzo[b]thiophene-2-carbonyl chloride, Benzothiophene-2-carboxaldehyde, 97% - 1G 1g, 19005-93-7, 35613-18-4, 39827-11-7,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.014g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	162.206g/mol
Monoisotopic Mass	162.014g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number