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84922-40-7 | 6-Quinolinamine, N-[(4-nitrophenyl)methylene]-
CAS No: 84922-40-7 Catalog No: AG004PPM MDL No:
Product Description
Catalog Number:
AG004PPM
Chemical Name:
6-Quinolinamine, N-[(4-nitrophenyl)methylene]-
CAS Number:
84922-40-7
Molecular Formula:
C16H11N3O2
Molecular Weight:
277.2774
IUPAC Name:
1-(4-nitrophenyl)-N-quinolin-6-ylmethanimine
InChI:
InChI=1S/C16H11N3O2/c20-19(21)15-6-3-12(4-7-15)11-18-14-5-8-16-13(10-14)2-1-9-17-16/h1-11H
InChI Key:
MRTGVHMDBZMJNR-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)C=Nc1ccc2c(c1)cccn2
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.085g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.283g/mol
Monoisotopic Mass:
277.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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