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165185-23-9 | 1-Naphthalenecarboxylic acid, 3-amino-4-hydroxy-
CAS No: 165185-23-9 Catalog No: AG001VZI MDL No:
Product Description
Catalog Number:
AG001VZI
Chemical Name:
1-Naphthalenecarboxylic acid, 3-amino-4-hydroxy-
CAS Number:
165185-23-9
Molecular Formula:
C11H9NO3
Molecular Weight:
203.1941
IUPAC Name:
3-amino-4-hydroxynaphthalene-1-carboxylic acid
InChI:
InChI=1S/C11H9NO3/c12-9-5-8(11(14)15)6-3-1-2-4-7(6)10(9)13/h1-5,13H,12H2,(H,14,15)
InChI Key:
DZZSVBQUFJJMCG-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(N)c(c2c1cccc2)O
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.058g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
203.197g/mol
Monoisotopic Mass:
203.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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