- InChI
- InChI=1S/C9H12N2O2/c1-6(12)11-7-3-4-9(13-2)8(10)5-7/h3-5H,10H2,1-2H3,(H,11,12)
- InChI Key
- SJWQCBCAGCEWCV-UHFFFAOYSA-N
- Formula
- C9H12N2O2
- SMILES
- COc1ccc(NC(C)=O)cc1N
- Molecular Weight1
- 180.20
- CAS
- 6375-47-9
- Other Names
-
- 4-Acetamino-2-aminoanisole
- 2-Amino-4-acetylaminoanisole
- Acetamide, N-(3-amino-4-methoxyphenyl)-
- 2-Amino-4-acetamidoanisole
- 3'-amino-4'-methoxyacetanilide
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°solid : Solid phase 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).
- 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 |
|---|---|---|---|
| ΔcH°solid | -4702.50 ± 5.80 | kJ/mol | NIST |
| ΔfG° | 39.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -173.04 | kJ/mol | Joback Calculated Property |
| ΔfH°solid | -554.00 ± 5.80 | kJ/mol | NIST |
| ΔfusH° | 25.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.46 | kJ/mol | Joback Calculated Property |
| log10WS | -1.43 | Crippen Calculated Property | |
| logPoct/wat | 1.236 | Crippen Calculated Property | |
| McVol | 141.310 | ml/mol | McGowan Calculated Property |
| Pc | 3607.21 | kPa | Joback Calculated Property |
| Tboil | 640.95 | K | Joback Calculated Property |
| Tc | 866.84 | K | Joback Calculated Property |
| Tfus | 450.73 | K | Joback Calculated Property |
| Vc | 0.519 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [355.33; 415.81] | J/mol×K | [640.95; 866.84] | 
|
| Cp,gas | 355.33 | J/mol×K | 640.95 | Joback Calculated Property |
| Cp,gas | 367.26 | J/mol×K | 678.60 | Joback Calculated Property |
| Cp,gas | 378.44 | J/mol×K | 716.25 | Joback Calculated Property |
| Cp,gas | 388.87 | J/mol×K | 753.89 | Joback Calculated Property |
| Cp,gas | 398.57 | J/mol×K | 791.54 | Joback Calculated Property |
| Cp,gas | 407.55 | J/mol×K | 829.19 | Joback Calculated Property |
| Cp,gas | 415.81 | J/mol×K | 866.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Amino-4-acetamino anisole.
Sources
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