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121586-62-7

121586-62-7 | Benzeneethanamine, N-ethyl-N-[4-[2-(4-nitrophenyl)diazenyl]phenyl]-

CAS No: 121586-62-7 Catalog No: AG0015BJ MDL No:

Product Description

Catalog Number:
AG0015BJ
Chemical Name:
Benzeneethanamine, N-ethyl-N-[4-[2-(4-nitrophenyl)diazenyl]phenyl]-
CAS Number:
121586-62-7
Molecular Formula:
C22H22N4O2
Molecular Weight:
374.4357
IUPAC Name:
N-ethyl-4-[(4-nitrophenyl)diazenyl]-N-(2-phenylethyl)aniline
InChI:
InChI=1S/C22H22N4O2/c1-2-25(17-16-18-6-4-3-5-7-18)21-12-8-19(9-13-21)23-24-20-10-14-22(15-11-20)26(27)28/h3-15H,2,16-17H2,1H3
InChI Key:
MGSWQZYXWKEPRF-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(cc1)N=Nc1ccc(cc1)[N+](=O)[O-])CCc1ccccc1

Properties

Complexity:
485  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.174g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
374.444g/mol
Monoisotopic Mass:
374.174g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
73.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6  

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