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89746-16-7 | Benzene, 1,1',1'',1''',1''''-(1-ethyl-2-pentene-1,2,3,4,5-pentayl)pentakis-
CAS No: 89746-16-7 Catalog No: AG0040N5 MDL No:
Product Description
Catalog Number:
AG0040N5
Chemical Name:
Benzene, 1,1',1'',1''',1''''-(1-ethyl-2-pentene-1,2,3,4,5-pentayl)pentakis-
CAS Number:
89746-16-7
Molecular Formula:
C37H34
Molecular Weight:
478.6659
IUPAC Name:
1,2,4,5-tetraphenylhept-3-en-3-ylbenzene
InChI:
InChI=1S/C37H34/c1-2-34(30-20-10-4-11-21-30)36(32-24-14-6-15-25-32)37(33-26-16-7-17-27-33)35(31-22-12-5-13-23-31)28-29-18-8-3-9-19-29/h3-27,34-35H,2,28H2,1H3
InChI Key:
MJYBQMZBRLGEJW-UHFFFAOYSA-N
SMILES:
CCC(C(=C(C(c1ccccc1)Cc1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
656
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
478.266g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
478.679g/mol
Monoisotopic Mass:
478.266g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
11.2
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