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Molecule
Cyclodecane
CAS: 293-96-9 · C10H20
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 293-96-9
- Molecular Formula
- C10H20
- Molecular Mass
- 140.27 g/mol
Identifiers
CAS Registry Number
293-96-9
SMILES
C1CCCCCCCCC1
InChI Key
LMGZGXSXHCMSAA-UHFFFAOYSA-N
InChI
InChI=1S/C10H20/c1-2-4-6-8-10-9-7-5-3-1/h1-10H2
Names and Synonyms
- Cyclodecane Synonym
- Cyclodecane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 140.27 g/mol | CAS Common Chemistry |
| Density | 0.86 g/cm³ | CAS Common Chemistry |
| 0.8577 g/cm3 @ 20.4 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Cyclodecane | CAS Common Chemistry |
| Boiling Point | 202 °C | CAS Common Chemistry |
| Canonical SMILES | C1CCCCCCCCC1 | CAS Common Chemistry |
| InChI | InChI=1S/C10H20/c1-2-4-6-8-10-9-7-5-3-1/h1-10H2 | CAS Common Chemistry |
| InChI Key | InChIKey=LMGZGXSXHCMSAA-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 10 °C | CAS Common Chemistry |
| Name | Cyclodecane | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 3.9010000000000034 | RDKit |
| 3.901 | RDKit | |
| 3.9 | chempirical lib | |
| Molar Refractivity | 46.17000000000002 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 140.15650064 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 = 140.27 g/mol; density = 0.860 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C10H20.
