- InChI
- InChI=1S/C3H7NO2/c1-2-3-6-4-5/h2-3H2,1H3
- InChI Key
- KAOQVXHBVNKNHA-UHFFFAOYSA-N
- Formula
- C3H7NO2
- SMILES
- CCCON=O
- Molecular Weight1
- 89.09
- CAS
- 543-67-9
- Other Names
-
- n-C3H7ONO
- n-Propyl nitrite
- Nitrous acid, propyl ester
- Nitrous acid, n-propyl ester
- Propanol nitrite
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔcH°liquid | -2030.00 ± 1.00 | kJ/mol | NIST |
| ΔfH°gas | -119.00 ± 4.20 | kJ/mol | NIST |
| ΔfH°liquid | -151.00 | kJ/mol | NIST |
| ΔvapH° | 32.00 | kJ/mol | NIST |
| IE | 10.34 ± 0.01 | eV | NIST |
| log10WS | -1.35 | Crippen Calculated Property | |
| logPoct/wat | 1.094 | Crippen Calculated Property | |
| McVol | 70.550 | ml/mol | McGowan Calculated Property |
| Pc | 4211.09 | kPa | Joback Calculated Property |
| Inp | [486.00; 486.00] |
|
|
| Inp | 486.00 | NIST | |
| Inp | 486.00 | NIST | |
| Tboil | [320.90; 330.00] | K |
|
| Tboil | 330.00 | K | NIST |
| Tboil | 320.90 ± 0.40 | K | NIST |
| Tc | 522.74 | K | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | 28.30 | kJ/mol | 260.50 | NIST |
Similar Compounds
Find more compounds similar to Propyl nitrite.
Sources
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