trans-Sabinol

trans-Sabinol
Compound Structure:
Synonyms: trans-Sabinol ;(E)-Sabinol; Q67880182
Compound ID: NMPC-1557
PubChem ID:

6429076
Molecular Formula: C10H16O
Canonical SMILES: CC(C)C12CC1C(=C)C(C2)O
InChIKey: MDFQXBNVOAKNAY-XVBQNVSMSA-N
About the compound:
Properties:

Computed Properties

Property Name

Property Value

Molecular Weight

152.23 g/mol

XLogP3-AA

1.8

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

1

Rotatable Bond Count

1

Exact Mass

152.120115130 g/mol

Monoisotopic Mass

152.120115130 g/mol

Topological Polar Surface Area

20.2Ų

Heavy Atom Count

11

Formal Charge

0

Complexity

207

Isotope Atom Count

0

Defined Atom Stereocenter Count

2

Undefined Atom Stereocenter Count

1

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source:PubChem
Source Species: Eucalyptus cloeziana
Eucalyptus torelliana
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