AG01AH1M

Name: 2-Chloro-5-(ethanesulfonyl)benzoic acid
Brand: Angene Chemical
SKU: AG01AH1M

90649-97-1 | 2-Chloro-5-(ethanesulfonyl)benzoic acid

AG01AH1M

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CAS Number	90649-97-1
Catalog Number	AG01AH1M(AGN-PC-06GJ70)
Chemical Name	2-Chloro-5-(ethanesulfonyl)benzoic acid
IUPAC Name	2-chloro-5-ethylsulfonylbenzoic acid
InChI	InChI=1S/C9H9ClO4S/c1-2-15(13,14)6-3-4-8(10)7(5-6)9(11)12/h3-5H,2H2,1H3,(H,11,12)
InChI Key	CJHDNODBCUENAN-UHFFFAOYSA-N
MDL Number	MFCD11103062
Molecular Formula	C9H9ClO4S
Molecular Weight	248.6834
SMILES	CCS(C1=CC(C(O)=O)=C(Cl)C=C1)(=O)=O
Synonyms	2-chloro-5-(ethanesulfonyl)benzoic acid, 90649-97-1, 2-Chloro-5-ethanesulfonyl-benzoic acid, AC1Q38BO, SCHEMBL3917292, CJHDNODBCUENAN-UHFFFAOYSA-N, ZINC34961650, AKOS009306712, MCULE-2663983505, NE33600, Benzoic acid, 2-chloro-5-(ethylsulfonyl)-, 2-Chloro-5-(ethane-2-sulfonyl)-benzoic acid, EN300-73427, Z1259339893,

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