Back to Search
Molecule
(+)-Limonene
CAS: 5989-27-5 · C10H16
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 5989-27-5
- Molecular Formula
- C10H16
- Molecular Mass
- 136.24 g/mol
Identifiers
CAS Registry Number
5989-27-5
SMILES
C=C(C)[C@H]1CC=C(C)CC1
InChI Key
XMGQYMWWDOXHJM-JTQLQIEISA-N
InChI
InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1
Names and Synonyms
- (+)-Limonene Synonym
- Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (4R)- Synonym
- p-Mentha-1,8-diene, (R)-(+)- Synonym
- Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (R)- Synonym
- (4R)-1-Methyl-4-(1-methylethenyl)cyclohexene Synonym
- (+)-p-Mentha-1,8-diene Synonym
- (+)-Limonene Synonym
- Carvene Synonym
- d-Limonene Synonym
- Limonene, (+)- Synonym
- D-(+)-Limonene Synonym
- (+)-(4R)-Limonene Synonym
- Refchole Synonym
- D-Limonene Synonym
- (+)-Dipentene Synonym
- d-(+)-Limonene Synonym
- (R)-p-Mentha-1,8-diene Synonym
- (+)-α-Limonene Synonym
- (4R)-(+)-Limonene Synonym
- (R)-(+)-p-Mentha-1,8-diene Synonym
- (R)-4-Isopropenyl-1-methyl-1-cyclohexene Synonym
- EC 7 Synonym
- Glidesafe Synonym
- Biogenic SE 374 Synonym
- Glidsafe Synonym
- (+)-(R)-Limonene Synonym
- (R)-(+)-Limonene Synonym
- (4R)-Limonene Synonym
- (R)-Limonene Synonym
- NK 1100 Synonym
- Fruits Dry Synonym
- 1-Methyl-4-prop-1-en-2-yl-cyclohexene Synonym
- Woody River 8 Synonym
- Bio Clear Synonym
- Clearene Synonym
- HistoSolve X Synonym
- Master Clear Synonym
- Safsolv Synonym
- Histo-Clear Synonym
- (R)-1-Methyl-4-(prop-1-en-2-yl)cyclohex-1-ene Synonym
- IVOD Synonym
- R-Limonene Synonym
- Alda 341 Synonym
- (4R)-1-Methyl-4-(prop-1-en-2-yl)cyclohex-1-ene Synonym
- HB 09 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 136.24 g/mol | CAS Common Chemistry |
| 136.23799999999997 g/mol | RDKit | |
| 136.238 g/mol | RDKit | |
| Density | 0.84 g/cm³ | CAS Common Chemistry |
| 0.8402 g/cm3 @ 25 °C | CAS Common Chemistry | |
| Canonical SMILES | C=C(C)C1CC=C(C)CC1 | CAS Common Chemistry |
| InChI | InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=XMGQYMWWDOXHJM-JTQLQIEISA-N | CAS Common Chemistry |
| Melting Point | -74.35 °C | CAS Common Chemistry |
| Name | (+)-Limonene | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 3.308900000000002 | RDKit |
| 3.3089 | RDKit | |
| 3.19 | chempirical lib | |
| Molar Refractivity | 45.91200000000003 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.6 | RDKit |
| Exact Mass | 136.125200512 g/mol | RDKit |
| Boiling Point | 175.5-176 °C @ 763 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
Convert
Quick conversion
MW = 136.24 g/mol; density = 0.840 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C10H16.
