AG019Z22

Name: 5-Chloro-2-(ethanesulfonyl)benzoic acid
Brand: Angene Chemical
SKU: AG019Z22

1384428-08-3 | 5-Chloro-2-(ethanesulfonyl)benzoic acid

AG019Z22

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CAS Number	1384428-08-3
Catalog Number	AG019Z22
Chemical Name	5-Chloro-2-(ethanesulfonyl)benzoic acid
IUPAC Name	5-chloro-2-ethylsulfonylbenzoic acid
InChI	InChI=1S/C9H9ClO4S/c1-2-15(13,14)8-4-3-6(10)5-7(8)9(11)12/h3-5H,2H2,1H3,(H,11,12)
InChI Key	AEHJFUBNRZVWAP-UHFFFAOYSA-N
MDL Number	MFCD22369825
Molecular Formula	C9H9ClO4S
Molecular Weight	248.6834
SMILES	CCS(C1=C(C(O)=O)C=C(Cl)C=C1)(=O)=O
Synonyms	5-chloro-2-(ethanesulfonyl)benzoic acid, 1384428-08-3, SCHEMBL19437582, ZINC74941702, AKOS022957654, MCULE-9400302183, NE56554, Z1695922870,

Complexity	333
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	247.991g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	248.677g/mol
Monoisotopic Mass	247.991g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	79.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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