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131032-76-3 | Benzenesulfonic acid, 5-amino-2-[2-(4-aminophenyl)ethenyl]-
CAS No: 131032-76-3 Catalog No: AG000VDG MDL No:
Product Description
Catalog Number:
AG000VDG
Chemical Name:
Benzenesulfonic acid, 5-amino-2-[2-(4-aminophenyl)ethenyl]-
CAS Number:
131032-76-3
Molecular Formula:
C14H14N2O3S
Molecular Weight:
290.3376
IUPAC Name:
5-amino-2-[2-(4-aminophenyl)ethenyl]benzenesulfonic acid
InChI:
InChI=1S/C14H14N2O3S/c15-12-6-2-10(3-7-12)1-4-11-5-8-13(16)9-14(11)20(17,18)19/h1-9H,15-16H2,(H,17,18,19)
InChI Key:
SZLHQHZVDSXZDG-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)C=Cc1ccc(cc1S(=O)(=O)O)N
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.073g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
290.337g/mol
Monoisotopic Mass:
290.073g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.6
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