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150044-10-3 | 1-Naphthalenamine, N,N-bis(4-nitrophenyl)-
CAS No: 150044-10-3 Catalog No: AG001M9U MDL No:
Product Description
Catalog Number:
AG001M9U
Chemical Name:
1-Naphthalenamine, N,N-bis(4-nitrophenyl)-
CAS Number:
150044-10-3
Molecular Formula:
C22H15N3O4
Molecular Weight:
385.3722
IUPAC Name:
N,N-bis(4-nitrophenyl)naphthalen-1-amine
InChI:
InChI=1S/C22H15N3O4/c26-24(27)19-12-8-17(9-13-19)23(18-10-14-20(15-11-18)25(28)29)22-7-3-5-16-4-1-2-6-21(16)22/h1-15H
InChI Key:
RNALZTKNRHNQHT-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)N(c1cccc2c1cccc2)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
540
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.106g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
385.379g/mol
Monoisotopic Mass:
385.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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