chempirical

Terpinolene

C10H16CAS 586-62-9136.24 g/mol

Open in Covalent MOL file
Alkene

Properties

Molecular formula
C10H16
Molar mass
136.24 g/mol
Exact mass
136.1252 Da
Density
0.8623 g/mL (at 20 °C)
Melting point
below 25 °C
Boiling point
185 °C
logP
3.45Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
586-62-9
SMILES
CC1=CCC(=C(C)C)CC1
InChIKey
MOYAFQVGZZPNRA-UHFFFAOYSA-N
InChI
InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4H,5-7H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

12 names
  • Cyclohexene, 1-methyl-4-(1-methylethylidene)-
  • p-Mentha-1,4(8)-diene
  • 1-Methyl-4-(1-methylethylidene)cyclohexene
  • α-Terpinolene
  • Terpinolen
  • 4-Isopropylidene-1-methylcyclohexene
  • Isoterpinene
  • Nofmer TP
  • δ-Terpinene
  • Terpinolene 95PF
  • 1-Methyl-4-propan-2-ylidene-cyclohexene
  • 1-Methyl-4-(propan-2-ylidene)cyclohex-1-ene

Work with Terpinolene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

γ-Bisabolene495-62-552 % similar 1-Methylcyclopropene3100-04-745 % similar Germacrone6902-91-640 % similar 1-Methylcyclopentene693-89-038 % similar Methylcyclohexene591-49-137 % similar Squalene111-02-434 % similar γ-Terpinene99-85-432 % similar 1-Methyl-1,4-cyclohexadiene4313-57-932 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Myrcene123-35-3 β-Pinene127-91-3 3-Carene13466-78-9 β-Ocimene13877-91-3 Limonene138-86-3 (-)-β-Pinene18172-67-3 (±)-α-Pinene2437-95-8 Adamantane281-23-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook