- InChI
- InChI=1S/C9H11N/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9H,5-6,10H2
- InChI Key
- XJEVHMGJSYVQBQ-UHFFFAOYSA-N
- Formula
- C9H11N
- SMILES
- NC1CCc2ccccc21
- Molecular Weight1
- 133.19
- CAS
- 61949-83-5
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| ω | 0.3970 | Relay (1.0) Calculated Property | |
| ΔfG° | 254.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 110.48 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.91 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.20 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.78 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.633 | Crippen Calculated Property | |
| McVol | 113.030 | ml/mol | McGowan Calculated Property |
| Pc | 4010.84 | kPa | Joback Calculated Property |
| Tboil | 502.16 | K | Relay (1.0) Calculated Property |
| Tc | 752.80 | K | Relay (1.0) Calculated Property |
| Tfus | 276.51 | K | Relay (1.0) Calculated Property |
| Vc | 0.404 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [256.72; 329.54] | J/mol×K | [516.25; 754.89] | 
|
| Cp,gas | 256.72 | J/mol×K | 516.25 | Joback Calculated Property |
| Cp,gas | 271.36 | J/mol×K | 556.02 | Joback Calculated Property |
| Cp,gas | 284.89 | J/mol×K | 595.80 | Joback Calculated Property |
| Cp,gas | 297.39 | J/mol×K | 635.57 | Joback Calculated Property |
| Cp,gas | 308.95 | J/mol×K | 675.34 | Joback Calculated Property |
| Cp,gas | 319.64 | J/mol×K | 715.12 | Joback Calculated Property |
| Cp,gas | 329.54 | J/mol×K | 754.89 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [369.70; 493.70] | K | [1.00; 99.60] |
|
| Tboilr | 369.70 | K | 1.00 | NIST |
| Tboilr | 493.70 | K | 99.60 | NIST |
Similar Compounds
Find more compounds similar to 1H-Inden-1-amine, 2,3-dihydro-, (.+/-.)-.
Sources
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