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28907-86-0 | 2-Naphthalenesulfonic acid, 7-[(4-aminophenyl)amino]-4-hydroxy-, sodium salt (1:1)
CAS No: 28907-86-0 Catalog No: AG002X1N MDL No:
Product Description
Catalog Number:
AG002X1N
Chemical Name:
2-Naphthalenesulfonic acid, 7-[(4-aminophenyl)amino]-4-hydroxy-, sodium salt (1:1)
CAS Number:
28907-86-0
Molecular Formula:
C16H13N2NaO4S
Molecular Weight:
352.3402
IUPAC Name:
sodium;7-(4-aminoanilino)-4-hydroxynaphthalene-2-sulfonate
InChI:
InChI=1S/C16H14N2O4S.Na/c17-11-1-3-12(4-2-11)18-13-5-6-15-10(7-13)8-14(9-16(15)19)23(20,21)22;/h1-9,18-19H,17H2,(H,20,21,22);/q;+1/p-1
InChI Key:
SZUCWICPXQIRGV-UHFFFAOYSA-M
SMILES:
Nc1ccc(cc1)Nc1ccc2c(c1)cc(cc2O)S(=O)(=O)[O-].[Na+]
EC Number:
249-305-2
Properties
Complexity:
505
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.049g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
352.34g/mol
Monoisotopic Mass:
352.049g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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