AG00G9XB

Name: 2,6-difluoro-3-methanesulfonylbenzoic acid
Brand: Angene Chemical
SKU: AG00G9XB

845617-17-6 | 2,6-difluoro-3-methanesulfonylbenzoic acid

AG00G9XB

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CAS Number	845617-17-6
Catalog Number	AG00G9XB(AGN-PC-0WBRZZ)
Chemical Name	2,6-difluoro-3-methanesulfonylbenzoic acid
IUPAC Name	2,6-difluoro-3-methylsulfonylbenzoic acid
InChI	InChI=1S/C8H6F2O4S/c1-15(13,14)5-3-2-4(9)6(7(5)10)8(11)12/h2-3H,1H3,(H,11,12)
InChI Key	IZGWQDLOGJHGFQ-UHFFFAOYSA-N
MDL Number	MFCD11179943
Molecular Formula	C8H6F2O4S
Molecular Weight	236.1926
SMILES	CS(C1=C(F)C(C(O)=O)=C(F)C=C1)(=O)=O
Synonyms	845617-17-6, 2,6-difluoro-3-methanesulfonylbenzoic acid, 2,6-Difluoro-3-(methylsulfonyl)benzoic acid, SCHEMBL4422508, IZGWQDLOGJHGFQ-UHFFFAOYSA-N, ZINC36894018, AKOS009308146, MCULE-5898529662, NE50134, 2,6-Difluoro-3-methanesulfonyl-benzoic acid, Benzoic acid, 2,6-difluoro-3-(methylsulfonyl)-, Z1696844462, 2,6-difluoro-3-methylsulfonylbenzoic acid,

Complexity	348
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	235.995g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	236.189g/mol
Monoisotopic Mass	235.995g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	79.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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