AG00IOAW

Name: 2-(p-Tolylthio)nicotinaldehyde
Brand: Angene Chemical
SKU: AG00IOAW

338982-20-0 | 2-(p-Tolylthio)nicotinaldehyde

AG00IOAW

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CAS Number	338982-20-0
Catalog Number	AG00IOAW(AGN-PC-0KKPOK)
Chemical Name	2-(p-Tolylthio)nicotinaldehyde
IUPAC Name	2-(4-methylphenyl)sulfanylpyridine-3-carbaldehyde
InChI	InChI=1S/C13H11NOS/c1-10-4-6-12(7-5-10)16-13-11(9-15)3-2-8-14-13/h2-9H,1H3
InChI Key	GBXIOMWDPVMNHG-UHFFFAOYSA-N
MDL Number	MFCD00794313
Molecular Formula	C13H11NOS
Molecular Weight	229.2975
SMILES	C1C=CN=C(SC2C=CC(C)=CC=2)C=1C=O
Synonyms	2-[(4-METHYLPHENYL)SULFANYL]NICOTINALDEHYDE, 2-(p-Tolylthio)nicotinaldehyde, 338982-20-0, 2-[(4-methylphenyl)sulfanyl]pyridine-3-carbaldehyde, AC1MC8M2, AC1Q2N12, SCHEMBL5553590, CTK7I0138, methylphenylsulfanylnicotinaldehyde, GBXIOMWDPVMNHG-UHFFFAOYSA-N, ZINC168334, KS-00001UM6, MFCD00794313, SBB097476, AKOS005070085, 2L-377S, MCULE-6010204946, RP13217, 2-[(4-methylphenyl)thio]nicotinaldehyde, TR-063073, 2-(4-methylphenylthio)pyridine-3-carbaldehyde, C-4139, 2-(4-methylphenylthio)pyridine-3-carboxaldehyde, 2-(4-methylphenyl)sulfanylpyridine-3-carbaldehyde, ZINC00168334, CID2763648,

Complexity	226
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.056g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	229.297g/mol
Monoisotopic Mass	229.056g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited