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100803-30-3 | Benzenemethanamine, N,N-bis[4-(2,2-diphenylethenyl)phenyl]-
CAS No: 100803-30-3 Catalog No: AG0002WV MDL No:
Product Description
Catalog Number:
AG0002WV
Chemical Name:
Benzenemethanamine, N,N-bis[4-(2,2-diphenylethenyl)phenyl]-
CAS Number:
100803-30-3
Molecular Formula:
C47H37N
Molecular Weight:
615.8034
IUPAC Name:
N-benzyl-4-(2,2-diphenylethenyl)-N-[4-(2,2-diphenylethenyl)phenyl]aniline
InChI:
InChI=1S/C47H37N/c1-6-16-39(17-7-1)36-48(44-30-26-37(27-31-44)34-46(40-18-8-2-9-19-40)41-20-10-3-11-21-41)45-32-28-38(29-33-45)35-47(42-22-12-4-13-23-42)43-24-14-5-15-25-43/h1-35H,36H2
InChI Key:
LZBUPFJDKPBUQW-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN(c1ccc(cc1)C=C(c1ccccc1)c1ccccc1)c1ccc(cc1)C=C(c1ccccc1)c1ccccc1
Properties
Complexity:
851
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
615.293g/mol
Formal Charge:
0
Heavy Atom Count:
48
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
615.82g/mol
Monoisotopic Mass:
615.293g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
13.4
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