Limonene oxide

Compound Structure:

Synonyms:

1-methyl-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptane; Limonene oxide; Limonene epoxide; Limonene 1,2-epoxide; Limonene monoxide; Limonene 1,2-oxide; 1,2-Epoxylimonene; 1,2-Epoxy-p-menth-8-ene; 7-Oxabicyclo[4.1.0]heptane, 1-methyl-4-(1-methylethenyl)-

Compound ID:

NMPC-1201

PubChem ID:

91496

Molecular Formula:

C10H16O

Canonical SMILES:

CC(=C)C1CCC2(C(C1)O2)C

InChIKey:

CCEFMUBVSUDRLG-UHFFFAOYSA-N

About the compound:

GHS Hazard Statements

• H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

• H317 (87.5%): May cause an allergic skin reaction [Warning Sensitization, Skin]

• H319 (12.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

• H335 (87.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Properties:

Chemical and Physical Properties

Property Name	Property Value
Molecular Weight	152.23 g/mol
XLogP3-AA	2.5
Hydrogen Bond Donor Count	0
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	12.5Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	197
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes
Physical Description	Colourless to pale yellow liquid; fresh clean citrus aroma
Density	0.926-0.936 (20Â°)

Source: PubChem

Source Species:

Cymbopogon citratus
Araucaria cunninghamii

Download SDF