- InChI
- InChI=1S/C3H9NO/c1-3(5)2-4/h3,5H,2,4H2,1H3/t3-/m1/s1
- InChI Key
- HXKKHQJGJAFBHI-GSVOUGTGSA-N
- Formula
- C3H9NO
- SMILES
- CC(O)CN
- Molecular Weight1
- 75.11
- CAS
- 2799-17-9
- Other Names
-
- (S)-(+)-1-Amino-2-propanol
- (S)-(+)-1-aminopropan-2-ol
- 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).
- Pvap : Vapor 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 |
|---|---|---|---|
| ω | 0.5817 | Relay (1.0) Calculated Property | |
| ΔfG° | -98.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -285.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 9.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.19 | eV | Relay (1.0) Calculated Property |
| log10WS | 1.20 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.674 | Crippen Calculated Property | |
| McVol | 68.980 | ml/mol | McGowan Calculated Property |
| Pc | 5495.11 | kPa | Joback Calculated Property |
| Tboil | 433.20 | K | NIST |
| Tc | 570.22 | K | Relay (1.0) Calculated Property |
| Tfus | 263.74 | K | Relay (1.0) Calculated Property |
| Vc | 0.250 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [142.31; 178.78] | J/mol×K | [432.31; 613.40] | 
|
| Cp,gas | 142.31 | J/mol×K | 432.31 | Joback Calculated Property |
| Cp,gas | 149.06 | J/mol×K | 462.49 | Joback Calculated Property |
| Cp,gas | 155.54 | J/mol×K | 492.67 | Joback Calculated Property |
| Cp,gas | 161.74 | J/mol×K | 522.85 | Joback Calculated Property |
| Cp,gas | 167.68 | J/mol×K | 553.03 | Joback Calculated Property |
| Cp,gas | 173.36 | J/mol×K | 583.21 | Joback Calculated Property |
| Cp,gas | 178.78 | J/mol×K | 613.40 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [331.52; 457.04] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.61162e+01 | |||
| Coefficient B | -4.27299e+03 | |||
| Coefficient C | -6.15660e+01 | |||
| Temperature range, min. | 331.52 | |||
| Temperature range, max. | 457.04 | |||
| Pvap | 1.33 | kPa | 331.52 | Calculated Property |
| Pvap | 2.90 | kPa | 345.47 | Calculated Property |
| Pvap | 5.87 | kPa | 359.41 | Calculated Property |
| Pvap | 11.15 | kPa | 373.36 | Calculated Property |
| Pvap | 20.05 | kPa | 387.31 | Calculated Property |
| Pvap | 34.36 | kPa | 401.25 | Calculated Property |
| Pvap | 56.43 | kPa | 415.20 | Calculated Property |
| Pvap | 89.26 | kPa | 429.15 | Calculated Property |
| Pvap | 136.52 | kPa | 443.09 | Calculated Property |
| Pvap | 202.64 | kPa | 457.04 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Propanol, 1-amino-, (S)-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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