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843673-87-0 | 1H-Benz[e]indole, 2-methyl-1,1-bis(phenylmethyl)-
CAS No: 843673-87-0 Catalog No: AG0055S5 MDL No:
Product Description
Catalog Number:
AG0055S5
Chemical Name:
1H-Benz[e]indole, 2-methyl-1,1-bis(phenylmethyl)-
CAS Number:
843673-87-0
Molecular Formula:
C27H23N
Molecular Weight:
361.4782
IUPAC Name:
1,1-dibenzyl-2-methylbenzo[e]indole
InChI:
InChI=1S/C27H23N/c1-20-27(18-21-10-4-2-5-11-21,19-22-12-6-3-7-13-22)26-24-15-9-8-14-23(24)16-17-25(26)28-20/h2-17H,18-19H2,1H3
InChI Key:
GRMIMWQZLDWWND-UHFFFAOYSA-N
SMILES:
CC1=Nc2c(C1(Cc1ccccc1)Cc1ccccc1)c1ccccc1cc2
Properties
Complexity:
531
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.183g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.488g/mol
Monoisotopic Mass:
361.183g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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