Name: Name:6-(4-methoxybenzenesulfonyl)pyridine-3-carboxylic acid
Brand: Angene
SKU: AG01BECW
Rating: 90 (10 reviews)

6-(4-methoxybenzenesulfonyl)pyridine-3-carboxylic acid

CAS No.:

1031599-54-8

Catalog Number:

AG01BECW

Molecular Formula:

C13H11NO5S

Molecular Weight:

293.2951

Catalog Number:

AG01BECW

Chemical Name:

6-(4-methoxybenzenesulfonyl)pyridine-3-carboxylic acid

CAS Number:

1031599-54-8

Molecular Formula:

C13H11NO5S

Molecular Weight:

293.2951

MDL Number:

MFCD11995665

IUPAC Name:

6-(4-methoxyphenyl)sulfonylpyridine-3-carboxylic acid

InChI:

InChI=1S/C13H11NO5S/c1-19-10-3-5-11(6-4-10)20(17,18)12-7-2-9(8-14-12)13(15)16/h2-8H,1H3,(H,15,16)

InChI Key:

GNCUFXAMTSWFGV-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)S(=O)(=O)c1ccc(cn1)C(=O)O

Complexity:

436

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

293.036g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

293.293g/mol

Monoisotopic Mass:

293.036g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

102A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5