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83763-45-5 | 1,7-Naphthalenedisulfonicacid, 2-amino-5-hydroxy-, sodium salt (1:1)
CAS No: 83763-45-5 Catalog No: AG004SP6 MDL No:
Product Description
Catalog Number:
AG004SP6
Chemical Name:
1,7-Naphthalenedisulfonicacid, 2-amino-5-hydroxy-, sodium salt (1:1)
CAS Number:
83763-45-5
Molecular Formula:
C10H8NNaO7S2
Molecular Weight:
341.2928
IUPAC Name:
sodium;7-amino-4-hydroxy-8-sulfonaphthalene-2-sulfonate
InChI:
InChI=1S/C10H9NO7S2.Na/c11-8-2-1-6-7(10(8)20(16,17)18)3-5(4-9(6)12)19(13,14)15;/h1-4,12H,11H2,(H,13,14,15)(H,16,17,18);/q;+1/p-1
InChI Key:
IRLXVIPGFBNBKE-UHFFFAOYSA-M
SMILES:
Oc1cc(cc2c1ccc(c2S(=O)(=O)O)N)S(=O)(=O)[O-].[Na+]
EC Number:
280-731-1
Properties
Complexity:
567
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.964g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
341.284g/mol
Monoisotopic Mass:
340.964g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
175A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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