- InChI
- InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,8H,1-2,6-7H2,3-4H3/b10-8-
- InChI Key
- XJPBRODHZKDRCB-NTMALXAHSA-N
- Formula
- C10H16
- SMILES
- C=CC(C)=CCCC(=C)C
- Molecular Weight1
- 136.23
- CAS
- 6874-44-8
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 272.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 98.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 36.63 | kJ/mol | Joback Calculated Property |
| log10WS | -3.57 | Crippen Calculated Property | |
| logPoct/wat | 3.475 | Crippen Calculated Property | |
| McVol | 138.860 | ml/mol | McGowan Calculated Property |
| Pc | 2421.88 | kPa | Joback Calculated Property |
| Tboil | 425.48 | K | Joback Calculated Property |
| Tc | 609.58 | K | Joback Calculated Property |
| Tfus | 165.94 | K | Joback Calculated Property |
| Vc | 0.539 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [267.94; 344.07] | J/mol×K | [425.48; 609.58] | 
|
| Cp,gas | 267.94 | J/mol×K | 425.48 | Joback Calculated Property |
| Cp,gas | 282.35 | J/mol×K | 456.16 | Joback Calculated Property |
| Cp,gas | 296.03 | J/mol×K | 486.85 | Joback Calculated Property |
| Cp,gas | 309.00 | J/mol×K | 517.53 | Joback Calculated Property |
| Cp,gas | 321.31 | J/mol×K | 548.21 | Joback Calculated Property |
| Cp,gas | 332.99 | J/mol×K | 578.90 | Joback Calculated Property |
| Cp,gas | 344.07 | J/mol×K | 609.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Alpha cis ocimene.
Sources
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