- InChI
- InChI=1S/C12H13N/c1-9(13)11-8-4-6-10-5-2-3-7-12(10)11/h2-9H,13H2,1H3/t9-/m1/s1
- InChI Key
- RTCUCQWIICFPOD-SECBINFHSA-N
- Formula
- C12H13N
- SMILES
- CC(N)c1cccc2ccccc12
- Molecular Weight1
- 171.24
- CAS
- 10420-89-0
- Other Names
-
- 1-Naphthalenemethanamine, «alpha»-methyl-, (S)-
- (S)-(-)-(1-Naphthyl)ethylamine
- L-«alpha»-(«alpha»-Naphthyl)ethylamine
- L-«alpha»-(1-Naphthyl)ethylamine
- S-(-)-1-(1-Naphthyl)ethylamine
- S-(-)-1-(«alpha»-Naphthyl)ethylamine
- (S)-«alpha»-Methyl-1-naphthalenemethanamine
- (1S)-1-(1-Naphthyl)ethanamine
- 1-Naphthalenemethanamine, alpha-methyl-, («alpha»S)-
- 1-Naphthalenemethanamine, «alpha»-methyl-, (S)-(-)-
- 1-Naphthalenemethanamine, «alpha»-methyl-, («alpha»S)-
- 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).
- 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 | 0.4775 | Relay (1.0) Calculated Property | |
| ΔfG° | 323.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 106.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.49 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.87 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.49 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.859 | Crippen Calculated Property | |
| McVol | 146.700 | ml/mol | McGowan Calculated Property |
| Pc | 3287.81 | kPa | Joback Calculated Property |
| Tboil | 560.56 | K | Relay (1.0) Calculated Property |
| Tc | 822.93 | K | Relay (1.0) Calculated Property |
| Tfus | 314.27 | K | Relay (1.0) Calculated Property |
| Vc | 0.521 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [355.08; 429.17] | J/mol×K | [596.89; 841.15] | 
|
| Cp,gas | 355.08 | J/mol×K | 596.89 | Joback Calculated Property |
| Cp,gas | 370.01 | J/mol×K | 637.60 | Joback Calculated Property |
| Cp,gas | 383.79 | J/mol×K | 678.31 | Joback Calculated Property |
| Cp,gas | 396.51 | J/mol×K | 719.02 | Joback Calculated Property |
| Cp,gas | 408.25 | J/mol×K | 759.73 | Joback Calculated Property |
| Cp,gas | 419.11 | J/mol×K | 800.44 | Joback Calculated Property |
| Cp,gas | 429.17 | J/mol×K | 841.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (S)-(-)-«alpha»-(1-Naphthyl)ethylamine.
Sources
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