AG00C601

Name: 2-{[(2E)-3-phenylprop-2-en-1-yl]thio}nicotinic acid
Brand: Angene Chemical
SKU: AG00C601

324779-96-6 | 2-{[(2E)-3-phenylprop-2-en-1-yl]thio}nicotinic acid

AG00C601

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COA

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$0.00

WARNING This product is not for human or veterinary use.

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CAS Number	324779-96-6
Catalog Number	AG00C601(AGN-PC-0WB4E2)
Chemical Name	2-{[(2E)-3-phenylprop-2-en-1-yl]thio}nicotinic acid
IUPAC Name	2-(3-phenylprop-2-enylsulfanyl)pyridine-3-carboxylic acid
InChI	InChI=1S/C15H13NO2S/c17-15(18)13-9-4-10-16-14(13)19-11-5-8-12-6-2-1-3-7-12/h1-10H,11H2,(H,17,18)
InChI Key	QJXFXWNDLUHFEU-UHFFFAOYSA-N
MDL Number	MFCD01795583
Molecular Formula	C15H13NO2S
Molecular Weight	271.3342
SMILES	C1(=CC=CC=C1)C=CCSC1=NC=CC=C1C(=O)O
Synonyms	324779-96-6, AC1MECQZ, 2-(Cinnamylthio)nicotinic acid, 2-{[(2E)-3-PHENYLPROP-2-EN-1-YL]THIO}NICOTINIC ACID, CHEMBRDG-BB 5919697, CTK4G8776, DTXSID70386904, AKOS030253911, MCULE-6670799030, 2-(3-phenylprop-2-enylsulfanyl)pyridine-3-carboxylic acid, CID2876355, 2-cinnamylsulfanylpyridine-3-carboxylic Acid,

Complexity	313
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	271.067g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	271.334g/mol
Monoisotopic Mass	271.067g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	75.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	1
XLogP3	3.4

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