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Home > Nitro Compounds > 23253-13-6
23253-13-6 | 1-Naphthalenesulfonic acid, 5-hydroxy-6-nitroso-
CAS No: 23253-13-6 Catalog No: AG002MNZ MDL No:
Product Description
Catalog Number:
AG002MNZ
Chemical Name:
1-Naphthalenesulfonic acid, 5-hydroxy-6-nitroso-
CAS Number:
23253-13-6
Molecular Formula:
C10H7NO5S
Molecular Weight:
253.2313
IUPAC Name:
5-hydroxy-6-nitrosonaphthalene-1-sulfonic acid
InChI:
InChI=1S/C10H7NO5S/c12-10-7-2-1-3-9(17(14,15)16)6(7)4-5-8(10)11-13/h1-5,12H,(H,14,15,16)
InChI Key:
LJXYJGREZPLWKB-UHFFFAOYSA-N
SMILES:
O=Nc1ccc2c(c1O)cccc2S(=O)(=O)O
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.004g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
253.228g/mol
Monoisotopic Mass:
253.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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