Free Chemical Databases
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[Synonyms]
1,3-Cyclopentadiene, 1,2,3,4,5,5-hexamethyl-
4087-50-7
[Structure]
[ Properties Computed from Structure]
Molecular Weight 150.26062 [g/mol] Molecular Formula C11H18 XLogP 3 H-Bond Donor 0 H-Bond Acceptor 0 Rotatable Bond Count 0 Exact Mass 150.140851 MonoIsotopic Mass 150.140851 Topological Polar Surface Area 0 Heavy Atom Count 11 Formal Charge 0 Complexity 223 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 0 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: 1,2,3,4,5,5-hexamethylcyclopenta-1,3-diene
Canonical SMILES: CC1=C(C(C(=C1C)C)(C)C)C
InChI: InChI=1/C11H18/c1-7-8(2)10(4)11(5,6)9(7)3/h1-6H3
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