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Molecule
Cyclopentadecane
CAS: 295-48-7 · C15H30
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 295-48-7
- Molecular Formula
- C15H30
- Molecular Mass
- 210.40 g/mol
Identifiers
CAS Registry Number
295-48-7
SMILES
C1CCCCCCCCCCCCCC1
InChI Key
SRONXYPFSAKOGH-UHFFFAOYSA-N
InChI
InChI=1S/C15H30/c1-2-4-6-8-10-12-14-15-13-11-9-7-5-3-1/h1-15H2
Names and Synonyms
- Cyclopentadecane Synonym
- Cyclopentadecane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 210.40 g/mol | CAS Common Chemistry |
| 210.40499999999994 g/mol | RDKit | |
| 210.405 g/mol | RDKit | |
| Density | 0.84 g/cm³ | CAS Common Chemistry |
| 0.8364 g/cm3 @ 61.5 °C | CAS Common Chemistry | |
| Canonical SMILES | C1CCCCCCCCCCCCCC1 | CAS Common Chemistry |
| InChI | InChI=1S/C15H30/c1-2-4-6-8-10-12-14-15-13-11-9-7-5-3-1/h1-15H2 | CAS Common Chemistry |
| InChI Key | InChIKey=SRONXYPFSAKOGH-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 61.3 °C | CAS Common Chemistry |
| Name | Cyclopentadecane | CAS Common Chemistry |
| Heavy Atom Count | 15 | 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 | 5.851500000000006 | RDKit |
| 5.8515 | RDKit | |
| 5.85 | chempirical lib | |
| Molar Refractivity | 69.25500000000007 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 210.23475095999999 g/mol | RDKit |
| Boiling Point | 45-60 °C @ 5 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
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Quick conversion
MW = 210.40 g/mol; density = 0.840 g/mL. Edit any field — others recompute live.
