AG00ABA2

Name: 2-((2-Methylbenzyl)thio)acetic acid
Brand: Angene Chemical
SKU: AG00ABA2

18926-49-3 | 2-((2-Methylbenzyl)thio)acetic acid

AG00ABA2

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CAS Number	18926-49-3
Catalog Number	AG00ABA2(AGN-PC-0WB4IA)
Chemical Name	2-((2-Methylbenzyl)thio)acetic acid
IUPAC Name	2-[(2-methylphenyl)methylsulfanyl]acetic acid
InChI	InChI=1S/C10H12O2S/c1-8-4-2-3-5-9(8)6-13-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)
InChI Key	RJOVEGRAZXURHL-UHFFFAOYSA-N
MDL Number	MFCD03547593
Molecular Formula	C10H12O2S
Molecular Weight	196.2661
SMILES	O=C(O)CSCC1=CC=CC=C1C
Synonyms	[(2-methylbenzyl)thio]acetic acid, 18926-49-3, 2-((2-Methylbenzyl)thio)acetic acid, [(2-methylbenzyl)sulfanyl]acetic acid, EN300-86709, 2-{[(2-methylphenyl)methyl]sulfanyl}acetic acid, AC1LIO3T, AC1Q2FEF, 2-[(2-methylphenyl)methylsulfanyl]acetic Acid, SCHEMBL10418735, CTK8H4084, DTXSID40359322, ZINC567353, ZX-CM016578, BBL000513, MFCD03547593, SP4199, STK805285, AKOS000138320, BBV-021016, MCULE-2262275281, ACM18926493, NCGC00327536-01, AJ-23521, 2-[(2-methylphenyl)methylthio]acetic acid, ST51015710, Y-0698, AB01322680-02, J-012210, CID958795,

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	2.3

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