AG019YTY

Name: 5-Chloro-2-(ethylsulfanyl)benzoic acid
Brand: Angene Chemical
SKU: AG019YTY

1249627-95-9 | 5-Chloro-2-(ethylsulfanyl)benzoic acid

AG019YTY

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CAS Number	1249627-95-9
Catalog Number	AG019YTY
Chemical Name	5-Chloro-2-(ethylsulfanyl)benzoic acid
IUPAC Name	5-chloro-2-ethylsulfanylbenzoic acid
InChI	InChI=1S/C9H9ClO2S/c1-2-13-8-4-3-6(10)5-7(8)9(11)12/h3-5H,2H2,1H3,(H,11,12)
InChI Key	AOUUCNTYVWAIHC-UHFFFAOYSA-N
MDL Number	MFCD16059694
Molecular Formula	C9H9ClO2S
Molecular Weight	216.6846
SMILES	CCSC1=C(C(O)=O)C=C(Cl)C=C1
Synonyms	5-chloro-2-(ethylsulfanyl)benzoic acid, 1249627-95-9, ZINC42804194, AKOS010873819, MCULE-7828619472, NE33867, Z1365534329,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.001g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.679g/mol
Monoisotopic Mass	216.001g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

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