- InChI
- InChI=1S/C9H13N/c1-7-4-5-9(10-3)6-8(7)2/h4-6,10H,1-3H3
- InChI Key
- XXABKSVWHJDSNO-UHFFFAOYSA-N
- Formula
- C9H13N
- SMILES
- CNc1ccc(C)c(C)c1
- Molecular Weight1
- 135.21
- 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).
- I : Polar retention indices.
- 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 | 0.4762 | Relay (1.0) Calculated Property | |
| ΔfG° | 207.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 36.23 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.54 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.06 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.38 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.345 | Crippen Calculated Property | |
| McVol | 123.890 | ml/mol | McGowan Calculated Property |
| Pc | 3199.16 | kPa | Joback Calculated Property |
| I | [1853.20; 1853.20] |
|
|
| I | 1853.20 | NIST | |
| I | 1853.20 | NIST | |
| Tboil | 504.22 | K | Relay (1.0) Calculated Property |
| Tc | 737.76 | K | Relay (1.0) Calculated Property |
| Tfus | 283.56 | K | Relay (1.0) Calculated Property |
| Vc | 0.445 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [261.09; 331.85] | J/mol×K | [492.13; 704.03] |
|
| Cp,gas | 261.09 | J/mol×K | 492.13 | Joback Calculated Property |
| Cp,gas | 274.56 | J/mol×K | 527.45 | Joback Calculated Property |
| Cp,gas | 287.34 | J/mol×K | 562.76 | Joback Calculated Property |
| Cp,gas | 299.43 | J/mol×K | 598.08 | Joback Calculated Property |
| Cp,gas | 310.87 | J/mol×K | 633.40 | Joback Calculated Property |
| Cp,gas | 321.67 | J/mol×K | 668.71 | Joback Calculated Property |
| Cp,gas | 331.85 | J/mol×K | 704.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N-Methyl-3,4-xylidine.
Sources
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