AG005MSE

Name: 2-[(2,4-dimethylphenyl)sulfanyl]acetic acid
Brand: Angene Chemical
SKU: AG005MSE

75243-12-8 | 2-[(2,4-dimethylphenyl)sulfanyl]acetic acid

AG005MSE

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CAS Number	75243-12-8
Catalog Number	AG005MSE(AGN-PC-0JMILY)
Chemical Name	2-[(2,4-dimethylphenyl)sulfanyl]acetic acid
IUPAC Name	2-(2,4-dimethylphenyl)sulfanylacetic acid
InChI	InChI=1S/C10H12O2S/c1-7-3-4-9(8(2)5-7)13-6-10(11)12/h3-5H,6H2,1-2H3,(H,11,12)
InChI Key	AFFPQRUZZYEZAU-UHFFFAOYSA-N
MDL Number	MFCD00838886
Molecular Formula	C10H12O2S
Molecular Weight	196.2661
NSC Number	406920
SMILES	CC1=CC(C)=C(SCC(O)=O)C=C1
Synonyms	[(2,4-dimethylphenyl)thio]acetic acid, 75243-12-8, 2-((2,4-Dimethylphenyl)thio)acetic acid, 2-[(2,4-dimethylphenyl)sulfanyl]acetic acid, NSC406920, AC1L88IN, AC1Q2I8O, SCHEMBL14273069, CTK8F2217, DTXSID70324523, ZINC1599543, MFCD00838886, AKOS000264646, 2-(2,4-dimethylphenylthio)acetic acid, NSC-406920, 2-(2,4-dimethylphenyl)sulfanylacetic acid, EN300-07704, [(2,4-dimethylphenyl)thio]acetic acid, AldrichCPR, Z55903769, CID347970,

Complexity	182
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.056g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	196.264g/mol
Monoisotopic Mass	196.056g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.6A^2
Undefined Atom Stereocenter Count	0
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