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Molecule
Camphor
CAS: 76-22-2 · C10H16O
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 76-22-2
- Molecular Formula
- C10H16O
- Molecular Mass
- 152.24 g/mol
Identifiers
CAS Registry Number
76-22-2
SMILES
CC12CCC(CC1=O)C2(C)C
InChI Key
DSSYKIVIOFKYAU-UHFFFAOYSA-N
InChI
InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3
Names and Synonyms
- Camphor Common Name
- Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl- Synonym
- Camphor Synonym
- 1,7,7-Trimethylbicyclo[2.2.1]heptan-2-one Synonym
- 2-Bornanone Synonym
- 1,7,7-Trimethylbicyclo[2.2.1]-2-heptanone Synonym
- Root bark oil Synonym
- Spirit of camphor Synonym
- 1,7,7-Trimethylnorcamphor Synonym
- 2-Camphanone Synonym
- Alphanon Synonym
- (±)-Camphor Synonym
- dl-Camphor Synonym
- DL-Camphor Synonym
- Racemic camphor Synonym
- Borneo camphor Synonym
- HCXL 8899 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 152.24 g/mol | CAS Common Chemistry |
| 152.237 g/mol | RDKit | |
| Density | 0.99 g/cm³ | CAS Common Chemistry |
| 0.992 g/cm3 @ 25 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Camphor | CAS Common Chemistry |
| Boiling Point | 204 °C | CAS Common Chemistry |
| Canonical SMILES | O=C1CC2CCC1(C)C2(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=DSSYKIVIOFKYAU-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 179 °C | CAS Common Chemistry |
| Name | (±)-Camphor | CAS Common Chemistry |
| Camphor | CAS Common Chemistry | |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 17.07 Ų | RDKit |
| LogP | 2.401700000000001 | RDKit |
| 2.4017 | RDKit | |
| Molar Refractivity | 44.23600000000002 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.9 | RDKit |
| Exact Mass | 152.120115132 g/mol | RDKit |
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
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MW = 152.24 g/mol; density = 0.990 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C10H16O.
