- InChI
- InChI=1S/C10H10/c1(3-9-5-6-9)2-4-10-7-8-10/h9-10H,5-8H2
- InChI Key
- QKYOSKNMZOKGDC-UHFFFAOYSA-N
- Formula
- C10H10
- SMILES
- C(C#CC1CC1)#CC1CC1
- Molecular Weight1
- 130.19
- CAS
- 114546-62-2
- 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° | 560.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 440.47 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.98 | kJ/mol | Joback Calculated Property |
| log10WS | -2.90 | Crippen Calculated Property | |
| logPoct/wat | 1.813 | Crippen Calculated Property | |
| McVol | 112.840 | ml/mol | McGowan Calculated Property |
| Pc | 3916.03 | kPa | Joback Calculated Property |
| Tboil | 459.68 | K | Joback Calculated Property |
| Tc | 708.70 | K | Joback Calculated Property |
| Tfus | 450.54 | K | Joback Calculated Property |
| Vc | 0.433 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [229.52; 310.13] | J/mol×K | [459.68; 708.70] | 
|
| Cp,gas | 229.52 | J/mol×K | 459.68 | Joback Calculated Property |
| Cp,gas | 245.84 | J/mol×K | 501.18 | Joback Calculated Property |
| Cp,gas | 260.86 | J/mol×K | 542.69 | Joback Calculated Property |
| Cp,gas | 274.68 | J/mol×K | 584.19 | Joback Calculated Property |
| Cp,gas | 287.43 | J/mol×K | 625.69 | Joback Calculated Property |
| Cp,gas | 299.21 | J/mol×K | 667.20 | Joback Calculated Property |
| Cp,gas | 310.13 | J/mol×K | 708.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,4-Dicyclopropylbuta-1,3-diyne.
Sources
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