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151226-51-6 | Benzenamine, 4,4'-(1,2-ethenediyl)bis[N-(3-methylphenyl)-N-phenyl-
CAS No: 151226-51-6 Catalog No: AG001N6G MDL No:
Product Description
Catalog Number:
AG001N6G
Chemical Name:
Benzenamine, 4,4'-(1,2-ethenediyl)bis[N-(3-methylphenyl)-N-phenyl-
CAS Number:
151226-51-6
Molecular Formula:
C40H34N2
Molecular Weight:
542.7114
IUPAC Name:
3-methyl-N-[4-[2-[4-(N-(3-methylphenyl)anilino)phenyl]ethenyl]phenyl]-N-phenylaniline
InChI:
InChI=1S/C40H34N2/c1-31-11-9-17-39(29-31)41(35-13-5-3-6-14-35)37-25-21-33(22-26-37)19-20-34-23-27-38(28-24-34)42(36-15-7-4-8-16-36)40-18-10-12-32(2)30-40/h3-30H,1-2H3
InChI Key:
IFPACJKZZJLVAK-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)N(c1ccccc1)c1ccc(cc1)C=Cc1ccc(cc1)N(c1cccc(c1)C)c1ccccc1
Properties
Complexity:
727
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
542.272g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
542.726g/mol
Monoisotopic Mass:
542.272g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
11.4
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