myrtenol

myrtenol
Compound Structure:
Synonyms: (6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)methanol; Myrtenol; 2-PINEN-10-OL; (-)-MYRTENOL, 97; (1R)-(-)-Myrtenol; Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-; (-)-Pin-2-ene-10-ol; alpha-Pinene-10-ol
Compound ID: NMPC-1282
PubChem ID:

10582

Molecular Formula: C10H16O
Canonical SMILES: CC1(C2CC=C(C1C2)CO)C
InChIKey: RXBQNMWIQKOSCS-UHFFFAOYSA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

152.23 g/mol

XLogP3-AA

1.6

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

20.2²

Heavy Atom Count

11

Formal Charge

0

Complexity

203

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

Compound Is Canonicalized

Yes

Physical Description

Colourless or pale straw-coloured liquid; Warm-herbaceous, slightly woody and discretely medicinal-camphoraceousodour of moderate to poor tenacity

Boiling Point

221.00 to 222.00 °C. @ 760.00 mm Hg

Density

0.976-0.983

Solubility 

Insoluble in water and propylene glycol; soluble in oils

Source: PubChem

Source Species: Araucaria cunninghamii
Boswellia dalzielii
Eucalyptus tereticornis
Eucalyptus torelliana
Cyperus articulatus
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