AG003VM8

99902-07-5 | 2-(Thiophen-2-yl)benzaldehyde

AG003VM8

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CAS Number	99902-07-5
Catalog Number	AG003VM8(AGN-PC-0KL7MA)
Chemical Name	2-(Thiophen-2-yl)benzaldehyde
IUPAC Name	2-thiophen-2-ylbenzaldehyde
InChI	InChI=1S/C11H8OS/c12-8-9-4-1-2-5-10(9)11-6-3-7-13-11/h1-8H
InChI Key	MWYVQGTVFMAUOH-UHFFFAOYSA-N
MDL Number	MFCD04039148
Molecular Formula	C11H8OS
Molecular Weight	188.2456
SMILES	O=CC1=C(C=CC=C1)C1=CC=CS1
Synonyms	2-(thiophen-2-yl)benzaldehyde, 99902-07-5, 2-thien-2-ylbenzaldehyde, 2-Thiophen-2-yl-benzaldehyde, 2-(2-thienyl)benzaldehyde, 2-thiophen-2-ylbenzaldehyde, zlchem 1145, AC1MDTNC, 2-(Thien-2-yl)benzaldehyde, Benzaldehyde,2-(2-thienyl)-, SCHEMBL1891145, CTK5I0763, DTXSID90383778, ZLD0613, MWYVQGTVFMAUOH-UHFFFAOYSA-N, KS-00000GI0, ZINC2525693, ANW-66740, MFCD04039148, SBB052166, 2-Thien-2-ylbenzaldehyde, AldrichCPR, AKOS000124632, MP-0339, PS-3697, RP03609, VZ25208, AJ-37499, AK-17912, CJ-08851, SC-26072, TC-155485, 4CH-007424, BB 0222525, FT-0642411, ST24027675, Y4903, A21948, J-510340, I14-59856, C11H8OS, 2-ethynyl-1,4-dimethoxy-benzene, ZINC02525693, CID2795558,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.03g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	188.244g/mol
Monoisotopic Mass	188.03g/mol
Rotatable Bond Count	2
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 Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number