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2007-20-7 | 2,7-Naphthalenedisulfonic acid, 4-amino-3-hydroxy-
CAS No: 2007-20-7 Catalog No: AG002CX2 MDL No:
Product Description
Catalog Number:
AG002CX2
Chemical Name:
2,7-Naphthalenedisulfonic acid, 4-amino-3-hydroxy-
CAS Number:
2007-20-7
Molecular Formula:
C10H9NO7S2
Molecular Weight:
319.3110
IUPAC Name:
4-amino-3-hydroxynaphthalene-2,7-disulfonic acid
InChI:
InChI=1S/C10H9NO7S2/c11-9-7-2-1-6(19(13,14)15)3-5(7)4-8(10(9)12)20(16,17)18/h1-4,12H,11H2,(H,13,14,15)(H,16,17,18)
InChI Key:
ADVCEUPBLBYYEF-UHFFFAOYSA-N
SMILES:
Nc1c2ccc(cc2cc(c1O)S(=O)(=O)O)S(=O)(=O)O
UNII:
4J1ZN24P49
Properties
Complexity:
561
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.982g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
319.302g/mol
Monoisotopic Mass:
318.982g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
172A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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