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247218-11-7

247218-11-7 | Benzenamine, N-[[4-(diethylamino)phenyl]methylene]-2-methyl-4-nitro-

CAS No: 247218-11-7 Catalog No: AG002P72 MDL No:

Product Description

Catalog Number:
AG002P72
Chemical Name:
Benzenamine, N-[[4-(diethylamino)phenyl]methylene]-2-methyl-4-nitro-
CAS Number:
247218-11-7
Molecular Formula:
C18H21N3O2
Molecular Weight:
311.3782
IUPAC Name:
N,N-diethyl-4-[(2-methyl-4-nitrophenyl)iminomethyl]aniline
InChI:
InChI=1S/C18H21N3O2/c1-4-20(5-2)16-8-6-15(7-9-16)13-19-18-11-10-17(21(22)23)12-14(18)3/h6-13H,4-5H2,1-3H3
InChI Key:
UASQRZGIPUICFG-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(cc1)C=Nc1ccc(cc1C)[N+](=O)[O-])CC

Properties

Complexity:
396  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.163g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.385g/mol
Monoisotopic Mass:
311.163g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

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