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88472-67-7

88472-67-7 | 1,4-Pentanediamine, N,N'-diphenyl-

CAS No: 88472-67-7 Catalog No: AG004AGG MDL No:

Product Description

Catalog Number:
AG004AGG
Chemical Name:
1,4-Pentanediamine, N,N'-diphenyl-
CAS Number:
88472-67-7
Molecular Formula:
C17H22N2
Molecular Weight:
254.3700
IUPAC Name:
1-N,4-N-diphenylpentane-1,4-diamine
InChI:
InChI=1S/C17H22N2/c1-15(19-17-12-6-3-7-13-17)9-8-14-18-16-10-4-2-5-11-16/h2-7,10-13,15,18-19H,8-9,14H2,1H3
InChI Key:
GGEPKTQZQRNFIL-UHFFFAOYSA-N
SMILES:
CC(Nc1ccccc1)CCCNc1ccccc1

Properties

Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.178g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
254.377g/mol
Monoisotopic Mass:
254.178g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  

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