p-Mentha-1,5,8-triene (1,5,8-p-Menthatriene)

p-Mentha-1,5,8-triene (1,5,8-p-Menthatriene)
Compound Structure:
Synonyms: 1,5,8-p-Menthatriene ;p-mentha-1,5,8-triene ;21195-59-5 ;1,3-Cyclohexadiene, 2-methyl-5-(1-methylethenyl)- 2-methyl-5-prop-1-en-2-ylcyclohexa-1,3-diene
Compound ID: NMPC-1426
PubChem ID:

527424
Molecular Formula: C10H14
Canonical SMILES: CC1=CCC(C=C1)C(=C)C
InChIKey: NJLNIOKPXKKALD-UHFFFAOYSA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

134.22 g/mol

XLogP3-AA

3.3

Hydrogen Bond Donor Count

0

Hydrogen Bond Acceptor Count

0

Rotatable Bond Count

1

Exact Mass

134.109550447 g/mol

Monoisotopic Mass

134.109550447 g/mol

Topological Polar Surface Area

0Ų

Heavy Atom Count

10

Formal Charge

0

Complexity

194

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

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: Terminalia catappa
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