Name: Name:Benzenesulfonic acid, 5-amino-2-[2-(4-nitro-2-sulfophenyl)ethenyl]-
Brand: Angene
SKU: AG000OZT
Rating: 90 (10 reviews)

Benzenesulfonic acid, 5-amino-2-[2-(4-nitro-2-sulfophenyl)ethenyl]-

CAS No.:

119-72-2

Catalog Number:

AG000OZT

Molecular Formula:

C14H12N2O8S2

Molecular Weight:

400.3837

Catalog Number:

AG000OZT

Chemical Name:

Benzenesulfonic acid, 5-amino-2-[2-(4-nitro-2-sulfophenyl)ethenyl]-

CAS Number:

119-72-2

Molecular Formula:

C14H12N2O8S2

Molecular Weight:

400.3837

MDL Number:

MFCD00035915

IUPAC Name:

5-amino-2-[(E)-2-(4-nitro-2-sulfophenyl)ethenyl]benzenesulfonic acid

InChI:

InChI=1S/C14H12N2O8S2/c15-11-5-3-9(13(7-11)25(19,20)21)1-2-10-4-6-12(16(17)18)8-14(10)26(22,23)24/h1-8H,15H2,(H,19,20,21)(H,22,23,24)/b2-1+

InChI Key:

GHBWBMDGBCKAQU-OWOJBTEDSA-N

SMILES:

Nc1ccc(c(c1)S(=O)(=O)O)C=Cc1ccc(cc1S(=O)(=O)O)[N+](=O)[O-]

EC Number:

204-346-5

Complexity:

747

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

400.004g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

400.376g/mol

Monoisotopic Mass:

400.004g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

197A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8