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69762-07-8 | 2,7-Naphthalenedisulfonic acid, 3,4,6-triamino-5-hydroxy-
CAS No: 69762-07-8 Catalog No: AG005I0R MDL No:
Product Description
Catalog Number:
AG005I0R
Chemical Name:
2,7-Naphthalenedisulfonic acid, 3,4,6-triamino-5-hydroxy-
CAS Number:
69762-07-8
Molecular Formula:
C10H11N3O7S2
Molecular Weight:
349.3402
IUPAC Name:
3,4,6-triamino-5-hydroxynaphthalene-2,7-disulfonic acid
InChI:
InChI=1S/C10H11N3O7S2/c11-7-4(21(15,16)17)1-3-2-5(22(18,19)20)8(12)10(14)6(3)9(7)13/h1-2,14H,11-13H2,(H,15,16,17)(H,18,19,20)
InChI Key:
WXJCYHAUDYBZMO-UHFFFAOYSA-N
SMILES:
Nc1c2c(cc(c1N)S(=O)(=O)O)cc(c(c2O)N)S(=O)(=O)O
Properties
Complexity:
626
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.004g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
349.332g/mol
Monoisotopic Mass:
349.004g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
224A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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