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Home > Nitro Compounds > 25060-05-3
25060-05-3 | 2-Naphthalenol, 1-[2-(4-methyl-3-nitrophenyl)diazenyl]-
CAS No: 25060-05-3 Catalog No: AG002QBN MDL No:
Product Description
Catalog Number:
AG002QBN
Chemical Name:
2-Naphthalenol, 1-[2-(4-methyl-3-nitrophenyl)diazenyl]-
CAS Number:
25060-05-3
Molecular Formula:
C17H13N3O3
Molecular Weight:
307.3034
IUPAC Name:
1-[(4-methyl-3-nitrophenyl)diazenyl]naphthalen-2-ol
InChI:
InChI=1S/C17H13N3O3/c1-11-6-8-13(10-15(11)20(22)23)18-19-17-14-5-3-2-4-12(14)7-9-16(17)21/h2-10,21H,1H3
InChI Key:
VRUWHFQTXRLIKX-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1N=Nc1ccc(c(c1)[N+](=O)[O-])C)cccc2
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.096g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.309g/mol
Monoisotopic Mass:
307.096g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
90.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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