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2519-10-0 | Benzene, 1,1',1'',1''',1''''-(1,3-cyclopentadiene-1,2,3,4,5-pentayl)pentakis-
CAS No: 2519-10-0 Catalog No: AG002QTD MDL No:MFCD00012263
Product Description
Catalog Number:
AG002QTD
Chemical Name:
Benzene, 1,1',1'',1''',1''''-(1,3-cyclopentadiene-1,2,3,4,5-pentayl)pentakis-
CAS Number:
2519-10-0
Molecular Formula:
C35H26
Molecular Weight:
446.5809
MDL Number:
MFCD00012263
IUPAC Name:
(2,3,4,5-tetraphenylcyclopenta-1,4-dien-1-yl)benzene
InChI:
InChI=1S/C35H26/c1-6-16-26(17-7-1)31-32(27-18-8-2-9-19-27)34(29-22-12-4-13-23-29)35(30-24-14-5-15-25-30)33(31)28-20-10-3-11-21-28/h1-25,31H
InChI Key:
YGLVWOUNCXBPJF-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1C(=C(C(=C1c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
681
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
446.203g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
446.593g/mol
Monoisotopic Mass:
446.203g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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