AG00FHOP

Name: 1,3-Benzenedicarboxylic acid, 5-[Methyl(Methylsulfonyl)aMino]-,MonoMethyl ester
Brand: Angene Chemical
SKU: AG00FHOP

695215-94-2 | 1,3-Benzenedicarboxylic acid, 5-[Methyl(Methylsulfonyl)aMino]-,MonoMethyl ester

AG00FHOP

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CAS Number	695215-94-2
Catalog Number	AG00FHOP(AGN-PC-0TVZQ7)
Chemical Name	1,3-Benzenedicarboxylic acid, 5-[Methyl(Methylsulfonyl)aMino]-,MonoMethyl ester
IUPAC Name	3-methoxycarbonyl-5-[methyl(methylsulfonyl)amino]benzoic acid
InChI	InChI=1S/C11H13NO6S/c1-12(19(3,16)17)9-5-7(10(13)14)4-8(6-9)11(15)18-2/h4-6H,1-3H3,(H,13,14)
InChI Key	FLJKJNQTDSNBLQ-UHFFFAOYSA-N
MDL Number	MFCD09954475
Molecular Formula	C11H13NO6S
Molecular Weight	287.2890
SMILES	O=C(O)C1=CC(N(C)S(=O)(C)=O)=CC(C(OC)=O)=C1
Synonyms	695215-94-2, 3-(Methoxycarbonyl)-5-(N-methylmethylsulfonamido)benzoic acid, 3-(Methoxycarbonyl)-5-[methyl(methylsulphonyl)amino]benzoic acid, 3-(Methoxycarbonyl)-5-[methyl(methylsulfonyl)amino]benzoic acid, FLJKJNQTDSNBLQ-UHFFFAOYSA-N, SCHEMBL165562, CTK6I9156, DTXSID10457041, ZX-AT003637, 0737AC, KM1277, MFCD09954475, OR2286, ZINC33414766, AJ-86048, PS-11033, AX8245475, AS-813/43502089, 3-Methyl 5-[methyl(methylsulphonyl)amino]isophthalate, 3-(methoxycarbonyl)-5-(N-methylmethanesulfonamido)benzoic acid, 3-(METHOXYCARBONYL)-5-(N-METHYLMETHYLSULFONAMIDO) BENZOIC ACID, C11H13NO6S, CID11150371, 3-(Methoxycarbonyl)-5-(N-methylmethylsulfonamido)benzoicacid, 3-methoxycarbonyl-5-(methyl-methylsulfonyl-amino)benzoic Acid,

Complexity	454
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	287.046g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	287.286g/mol
Monoisotopic Mass	287.046g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	109A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

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