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7714-72-9 | Benzene, (cyclopentylidenephenylmethyl)-
CAS No: 7714-72-9 Catalog No: AG0055IL MDL No:
Product Description
Catalog Number:
AG0055IL
Chemical Name:
Benzene, (cyclopentylidenephenylmethyl)-
CAS Number:
7714-72-9
Molecular Formula:
C18H18
Molecular Weight:
234.3355
IUPAC Name:
[cyclopentylidene(phenyl)methyl]benzene
InChI:
InChI=1S/C18H18/c1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2
InChI Key:
POPQCIZUXRKKGP-UHFFFAOYSA-N
SMILES:
C1CCC(=C(c2ccccc2)c2ccccc2)C1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.141g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.342g/mol
Monoisotopic Mass:
234.141g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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