AG019VA0

Name: 4-Acetamido-3-(methylsulfanyl)benzoic acid
Brand: Angene Chemical
SKU: AG019VA0

1147657-04-2 | 4-Acetamido-3-(methylsulfanyl)benzoic acid

AG019VA0

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CAS Number	1147657-04-2
Catalog Number	AG019VA0
Chemical Name	4-Acetamido-3-(methylsulfanyl)benzoic acid
IUPAC Name	4-acetamido-3-methylsulfanylbenzoic acid
InChI	InChI=1S/C10H11NO3S/c1-6(12)11-8-4-3-7(10(13)14)5-9(8)15-2/h3-5H,1-2H3,(H,11,12)(H,13,14)
InChI Key	JIIDNHJBFBCZIB-UHFFFAOYSA-N
MDL Number	MFCD12197087
Molecular Formula	C10H11NO3S
Molecular Weight	225.2642
SMILES	C(C)(=O)NC1=C(C=C(C(=O)O)C=C1)SC
Synonyms	4-acetamido-3-(methylsulfanyl)benzoic acid, 1147657-04-2, AC1Q4GWQ, CTK7B4852, ZINC32938002, AKOS034364403, MCULE-9369396569, NE48585, EN300-44199, Z451350532,

Complexity	257
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	225.046g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	225.262g/mol
Monoisotopic Mass	225.046g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	91.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

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