AG00D1W9

Name: 2-((3-Methylbenzyl)thio)acetic acid
Brand: Angene Chemical
SKU: AG00D1W9

34722-35-5 | 2-((3-Methylbenzyl)thio)acetic acid

AG00D1W9

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COA

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CAS Number	34722-35-5
Catalog Number	AG00D1W9(AGN-PC-0RA3D8)
Chemical Name	2-((3-Methylbenzyl)thio)acetic acid
IUPAC Name	2-[(3-methylphenyl)methylsulfanyl]acetic acid
InChI	InChI=1S/C10H12O2S/c1-8-3-2-4-9(5-8)6-13-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)
InChI Key	RHZMAMPKKQBGSV-UHFFFAOYSA-N
MDL Number	MFCD05263737
Molecular Formula	C10H12O2S
Molecular Weight	196.2661
SMILES	CC1=CC(CSCC(O)=O)=CC=C1
Synonyms	34722-35-5, [(3-methylbenzyl)sulfanyl]acetic acid, [(3-methylbenzyl)thio]acetic acid, 2-((3-Methylbenzyl)thio)acetic acid, 2-{[(3-methylphenyl)methyl]sulfanyl}acetic acid, AC1Q2NJB, 2-[(3-methylphenyl)methylsulfanyl]acetic Acid, AC1MV69O, SCHEMBL10419640, HMS1754N04, ZINC3887635, BBL002111, MFCD05263737, STK894891, AKOS000264401, MCULE-2147732757, (3-METHYLBENZYL)THIO]ACETIC ACID, NCGC00339498-01, T7727, EN300-09087, AB01332527-02, Z19692175, CID3727896,

Complexity	170
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	4
Topological Polar Surface Area	62.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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