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87340-14-5 | Benzenamine, 4-[2-(4-methoxyphenyl)ethenyl]-N,N-bis(4-methylphenyl)-
CAS No: 87340-14-5 Catalog No: AG004L1D MDL No:
Product Description
Catalog Number:
AG004L1D
Chemical Name:
Benzenamine, 4-[2-(4-methoxyphenyl)ethenyl]-N,N-bis(4-methylphenyl)-
CAS Number:
87340-14-5
Molecular Formula:
C29H27NO
Molecular Weight:
405.5308
IUPAC Name:
N-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
InChI:
InChI=1S/C29H27NO/c1-22-4-14-26(15-5-22)30(27-16-6-23(2)7-17-27)28-18-10-24(11-19-28)8-9-25-12-20-29(31-3)21-13-25/h4-21H,1-3H3
InChI Key:
GRHBOSVRYBZQJA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C=Cc1ccc(cc1)N(c1ccc(cc1)C)c1ccc(cc1)C
Properties
Complexity:
505
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
405.209g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
405.541g/mol
Monoisotopic Mass:
405.209g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
8.1
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