- InChI
- InChI=1S/C9H11NO/c1-11-8-3-2-7-4-5-10-9(7)6-8/h2-3,6,10H,4-5H2,1H3
- InChI Key
- GKFGHNMPMAXWQS-UHFFFAOYSA-N
- Formula
- C9H11NO
- SMILES
- COc1ccc2c(c1)NCC2
- Molecular Weight1
- 149.19
- 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).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 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° | 169.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -16.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.62 | kJ/mol | Joback Calculated Property |
| log10WS | -1.88 | Crippen Calculated Property | |
| logPoct/wat | 1.663 | Crippen Calculated Property | |
| McVol | 118.900 | ml/mol | McGowan Calculated Property |
| Pc | 3857.88 | kPa | Joback Calculated Property |
| Inp | [1503.00; 1515.00] |
|
|
| Inp | 1503.00 | NIST | |
| Inp | 1515.00 | NIST | |
| Inp | 1503.00 | NIST | |
| I | [2384.00; 2412.00] |
|
|
| I | 2384.00 | NIST | |
| I | 2412.00 | NIST | |
| I | 2384.00 | NIST | |
| Tboil | 524.34 | K | Joback Calculated Property |
| Tc | 756.04 | K | Joback Calculated Property |
| Tfus | 392.09 | K | Joback Calculated Property |
| Vc | 0.445 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [262.73; 332.78] | J/mol×K | [524.34; 756.04] |
|
| Cp,gas | 262.73 | J/mol×K | 524.34 | Joback Calculated Property |
| Cp,gas | 276.35 | J/mol×K | 562.96 | Joback Calculated Property |
| Cp,gas | 289.15 | J/mol×K | 601.57 | Joback Calculated Property |
| Cp,gas | 301.15 | J/mol×K | 640.19 | Joback Calculated Property |
| Cp,gas | 312.40 | J/mol×K | 678.81 | Joback Calculated Property |
| Cp,gas | 322.93 | J/mol×K | 717.42 | Joback Calculated Property |
| Cp,gas | 332.78 | J/mol×K | 756.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 6-methoxy-dihydroindole.
Sources
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