- InChI
- InChI=1S/C9H8N2/c10-8-5-7-3-1-2-4-9(7)11-6-8/h1-6H,10H2
- InChI Key
- SVNCRRZKBNSMIV-UHFFFAOYSA-N
- Formula
- C9H8N2
- SMILES
- Nc1cnc2ccccc2c1
- Molecular Weight1
- 144.17
- CAS
- 580-17-6
- Other Names
-
- Quinoline, 3-amino-
- 3-Aminoquinoline
- 3-Quinolineamine
- 3-Quinolylamine
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔsubH : Enthalpy of sublimation at a given temperature (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).
- 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 | 0.5180 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -4790.20 ± 1.60 | kJ/mol | NIST |
| ΔfG° | 286.26 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 208.40 ± 2.20 | kJ/mol | NIST |
| ΔfH°solid | 105.30 ± 2.00 | kJ/mol | NIST |
| ΔsubH° | [103.10; 104.80] | kJ/mol |
|
| ΔsubH° | 103.10 ± 0.90 | kJ/mol | NIST |
| ΔsubH° | 103.10 | kJ/mol | NIST |
| ΔsubH° | 103.10 ± 0.90 | kJ/mol | NIST |
| ΔsubH° | 104.80 ± 4.80 | kJ/mol | NIST |
| ΔvapH° | 76.19 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.27 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.62 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.817 | Crippen Calculated Property | |
| McVol | 114.410 | ml/mol | McGowan Calculated Property |
| Pc | 4805.72 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 599.38 | K | Relay (1.0) Calculated Property |
| Tc | 885.35 | K | Relay (1.0) Calculated Property |
| Tfus | 429.65 ± 2.00 | K | NIST |
| Vc | 0.423 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔsubH | 101.10 ± 0.90 | kJ/mol | 337.00 | NIST |
Similar Compounds
Find more compounds similar to 3-Quinolinamine.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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