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Home > Indoles and Oxindole > 213670-22-5
213670-22-5 | 7-(2,2-Diphenylvinyl)-4-(p-tolyl)-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indole
CAS No: 213670-22-5 Catalog No: AG0072NU MDL No:MFCD11977250
Product Description
Catalog Number:
AG0072NU
Chemical Name:
7-(2,2-Diphenylvinyl)-4-(p-tolyl)-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indole
CAS Number:
213670-22-5
Molecular Formula:
C32H29N
Molecular Weight:
427.5794
MDL Number:
MFCD11977250
IUPAC Name:
7-(2,2-diphenylethenyl)-4-(4-methylphenyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole
InChI:
InChI=1S/C32H29N/c1-23-15-18-27(19-16-23)33-31-14-8-13-28(31)30-22-24(17-20-32(30)33)21-29(25-9-4-2-5-10-25)26-11-6-3-7-12-26/h2-7,9-12,15-22,28,31H,8,13-14H2,1H3
InChI Key:
QZEOZXJABDDEGH-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)N1c2ccc(cc2C2C1CCC2)C=C(c1ccccc1)c1ccccc1
Properties
Complexity:
640
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
427.23g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
427.591g/mol
Monoisotopic Mass:
427.23g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
8.9
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