Free Chemical Databases
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[Synonyms]
3,7-Dimethyloct-6-en-2-ol
STOCK1N-10881
6-Octen-2-ol, 3,7-dimethyl-
EINECS 237-931-9
AI3-24713
14087-07-1
[Structure]
[ Properties Computed from Structure]
Molecular Weight 156.2652 [g/mol] Molecular Formula C10H20O XLogP 3 H-Bond Donor 1 H-Bond Acceptor 1 Rotatable Bond Count 4 Exact Mass 156.151415 MonoIsotopic Mass 156.151415 Topological Polar Surface Area 20.2 Heavy Atom Count 11 Formal Charge 0 Complexity 123 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 2 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: 3,7-dimethyloct-6-en-2-ol
Canonical SMILES: CC(CCC=C(C)C)C(C)O
InChI: InChI=1/C10H20O/c1-8(2)6-5-7-9(3)10(4)11/h6,9-11H,5,7H2,1-4H3
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