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113703-66-5,MFCD00060108
Catalog No.:AA0009BV
113703-66-5 | 1,4-Benzenediamine, N1,N4-bis(4-chlorophenyl)-N1,N4-diphenyl-
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Technical Information
Catalog Number:
AA0009BV
Chemical Name:
1,4-Benzenediamine, N1,N4-bis(4-chlorophenyl)-N1,N4-diphenyl-
CAS Number:
113703-66-5
Molecular Formula:
C30H22Cl2N2
Molecular Weight:
481.4151
MDL Number:
MFCD00060108
IUPAC Name:
1-N,4-N-bis(4-chlorophenyl)-1-N,4-N-diphenylbenzene-1,4-diamine
InChI:
InChI=1S/C30H22Cl2N2/c31-23-11-15-27(16-12-23)33(25-7-3-1-4-8-25)29-19-21-30(22-20-29)34(26-9-5-2-6-10-26)28-17-13-24(32)14-18-28/h1-22H
InChI Key:
SQYNUFZUOMNRHQ-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)N(c1ccccc1)c1ccc(cc1)N(c1ccc(cc1)Cl)c1ccccc1
Properties
Computed Properties
 
Complexity:
527  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
480.116g/mol
Formal Charge:
0
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
481.42g/mol
Monoisotopic Mass:
480.116g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.7  

Synonyms
 
113703-66-5 
N,N'-Bis(4-chlorophenyl)-N,N'-diphenyl-1,4-phenylenediamine 
AKOS015850252 
TRA-0206612 
TR-002621 
FT-0726935 
C-44730 
N,N'-Bis(p-chlorophenyl)-N,N'-diphenyl-p-phenylenediamine 
n,n-bis(4-chlorophenyl)-n,n-diphenyl-1,4-phenylenediamine 
4',4''-Dichloro-N,N,N',N'-tetraphenyl-1,4-phenylenediamine 
n,n'-diphenyl-n,n'-di-(4-chlorophenyl)-1,4-phenylenediamine 
N1,N4-bis(4-chlorophenyl)-N1,N4-diphenylbenzene-1,4-diamine 
SQYNUFZUOMNRHQ-UHFFFAOYSA-N 
1,4-Benzenediamine,N1,N4-bis(4-chlorophenyl)-N1,N4-diphenyl- 
1-N,4-N-bis(4-chlorophenyl)-1-N,4-N-diphenylbenzene-1,4-diamine 
N~1~,N~4~-Bis(4-chlorophenyl)-N~1~,N~4~-diphenylbenzene-1,4-diamine 
B1336 
N1,N1-Bis(4-chlorophenyl)-N4,N4-diphenylbenzene-1,4-diamine 
ACMC-2099k0 
SCHEMBL3419224 
CTK4A8406 
DTXSID40618769 
ZINC2528026 
ANW-16654 
MFCD00060108 
Literature
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