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29743-21-3 | Benzenamine, N,N'-(1,4-phenylenedimethylidyne)bis[4-butyl-
CAS No: 29743-21-3 Catalog No: AG002ZAD MDL No:
Product Description
Catalog Number:
AG002ZAD
Chemical Name:
Benzenamine, N,N'-(1,4-phenylenedimethylidyne)bis[4-butyl-
CAS Number:
29743-21-3
Molecular Formula:
C28H32N2
Molecular Weight:
396.5671
IUPAC Name:
N-(4-butylphenyl)-1-[4-[(4-butylphenyl)iminomethyl]phenyl]methanimine
InChI:
InChI=1S/C28H32N2/c1-3-5-7-23-13-17-27(18-14-23)29-21-25-9-11-26(12-10-25)22-30-28-19-15-24(16-20-28)8-6-4-2/h9-22H,3-8H2,1-2H3
InChI Key:
OWDOPPGNUYIHFQ-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)N=Cc1ccc(cc1)C=Nc1ccc(cc1)CCCC
NSC Number:
171004
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.257g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.578g/mol
Monoisotopic Mass:
396.257g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
24.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.3
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