α – fenchene

Compound Structure:

Synonyms:

alpha-Fenchene ;471-84-1 ;7,7-DIMETHYL-2-METHYLIDENEBICYCLO[2.2.1]HEPTANE; Bicyclo[2.2.1]heptane, 7,7-dimethyl-2-methylene- (-)-7,7-Dimethyl-2-methylenebicyclo[2.2.1]heptane

Compound ID:

NMPC-1607

PubChem ID:

28930

Molecular Formula:

C10H16

Canonical SMILES:

CC1(C2CCC1C(=C)C2)C

InChIKey:

XCPQUQHBVVXMRQ-UHFFFAOYSA-N

About the compound:

GHS Hazard Statements

• H304 (100%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]

• H411 (92.86%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

Properties:

Chemical and Physical Properties

Molecular Weight	136.23 g/mol
XLogP3-AA	3.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	136.125200510 g/mol
Monoisotopic Mass	136.125200510 g/mol
Topological Polar Surface Area	0Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	177
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
Molecular Weight	136.23 g/mol

Source:PubChem

Source Species:

Ocimum basilicum
Acalypha ornata
Eucalyptus cloeziana

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