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75885-15-3 | 2-Naphthalenesulfonic acid, 6-[(3-aminobenzoyl)amino]-4-hydroxy-
CAS No: 75885-15-3 Catalog No: AG0059UJ MDL No:
Product Description
Catalog Number:
AG0059UJ
Chemical Name:
2-Naphthalenesulfonic acid, 6-[(3-aminobenzoyl)amino]-4-hydroxy-
CAS Number:
75885-15-3
Molecular Formula:
C17H14N2O5S
Molecular Weight:
358.3685
IUPAC Name:
6-[(3-aminobenzoyl)amino]-4-hydroxynaphthalene-2-sulfonic acid
InChI:
InChI=1S/C17H14N2O5S/c18-12-3-1-2-11(6-12)17(21)19-13-5-4-10-7-14(25(22,23)24)9-16(20)15(10)8-13/h1-9,20H,18H2,(H,19,21)(H,22,23,24)
InChI Key:
UBHWQNFHGOVOPU-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)C(=O)Nc1ccc2c(c1)c(O)cc(c2)S(=O)(=O)O
Properties
Complexity:
590
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.062g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
358.368g/mol
Monoisotopic Mass:
358.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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