AG001ZLI

Name: 2-[(4-methylphenyl)thio]propanoic acid
Brand: Angene Chemical
SKU: AG001ZLI

17431-98-0 | 2-[(4-methylphenyl)thio]propanoic acid

AG001ZLI

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CAS Number	17431-98-0
Catalog Number	AG001ZLI(AGN-PC-0O4XIZ)
Chemical Name	2-[(4-methylphenyl)thio]propanoic acid
IUPAC Name	2-(4-methylphenyl)sulfanylpropanoic acid
InChI	InChI=1S/C10H12O2S/c1-7-3-5-9(6-4-7)13-8(2)10(11)12/h3-6,8H,1-2H3,(H,11,12)
InChI Key	QZQJNDLCXSAWEN-UHFFFAOYSA-N
MDL Number	MFCD06380365
Molecular Formula	C10H12O2S
Molecular Weight	196.2661
SMILES	C(O)(=O)C(C)SC1=CC=C(C=C1)C
Synonyms	17431-98-0, 2-[(4-methylphenyl)thio]propanoic acid, 2-[(4-methylphenyl)sulfanyl]propanoic acid, 2-(p-Tolylthio)propanoic acid, SCHEMBL11574943, BBL000599, SP4210, STK825543, 2-(4-Methylphenylthio)propanoic acid, AKOS000264494, AKOS017268696, MCULE-2194590140, VS-00653, Propanoic acid, 2-[(4-methylphenyl)thio]-, EN300-12035, Y-2209, Z56278800, AC1NLPMC, AC1Q2C47, 2-(4-methylphenyl)sulfanylpropanoic Acid, CID4961775, (2R)-2-(4-methylphenyl)sulfanylpropanoate, 2-[(4-METHYLPHENYL)THIO]PROPANOICACID,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.055801g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	196.27g/mol
Monoisotopic Mass	196.055801g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.6Å²
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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