- InChI
- InChI=1S/C3H6ClNO/c1-5(2)3(4)6/h1-2H3
- InChI Key
- YIIMEMSDCNDGTB-UHFFFAOYSA-N
- Formula
- C3H6ClNO
- SMILES
- CN(C)C(=O)Cl
- Molecular Weight1
- 107.54
- Other Names
-
- (Dimethylamino)carbonyl chloride
- Carbamic chloride, N,N-dimethyl-
- Carbamoyl chloride, dimethyl-
- Carbamyl chloride, N,N-dimethyl-
- Chlorid kyseliny dimethylkarbaminove
- Chloroformic acid dimethylamide
- DMCC
- Dimethylamid kyseliny chlormravenci
- Dimethylcarbamic acid chloride
- Dimethylcarbamic chloride
- Dimethylcarbamidoyl chloride
- Dimethylcarbamoyl chloride
- Dimethylcarbamyl chloride
- Dimethylchloroformamide
- Dimethylkarbamoylchlorid
- N,N-Dimethylaminocarbonyl chloride
- N,N-Dimethylcarbamic acid chloride
- N,N-Dimethylcarbamidoyl chloride
- N,N-Dimethylcarbamoyl chloride
- N,N-Dimethylcarbamyl chloride
- NSC 122671
- Rcra waste number U097
- TL 389
- UN 2262
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.3490 | Relay (1.0) Calculated Property | |
| ΔfG° | -55.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -235.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.15 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.68 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.11 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.907 | Crippen Calculated Property | |
| McVol | 76.920 | ml/mol | McGowan Calculated Property |
| Pc | 4553.06 | kPa | Joback Calculated Property |
| Tboil | 427.51 | K | Relay (1.0) Calculated Property |
| Tc | 586.83 | K | Relay (1.0) Calculated Property |
| Tfus | 270.17 | K | Relay (1.0) Calculated Property |
| Vc | 0.308 | m3/kmol | Relay (1.0) Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 440.70 | K | 103.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [98.96; 209.42] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 9.72000e+00 | |||
| Coefficient B | 3.91540e-01 | |||
| Coefficient C | -2.53700e-04 | |||
| Coefficient D | 6.18600e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 98.96 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 119.22 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 137.03 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 152.58 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 166.07 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 177.69 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 187.64 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 196.12 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 203.31 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 209.42 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Carbamic chloride, dimethyl-.
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