- InChI
- InChI=1S/C6H11Cl2N3O2/c7-1-3-9-5(12)11-6(13)10-4-2-8/h1-4H2,(H3,9,10,11,12,13)
- InChI Key
- YEAPZDVWWPEUCZ-UHFFFAOYSA-N
- Formula
- C6H11Cl2N3O2
- SMILES
- O=C(NCCCl)NC(=O)NCCCl
- Molecular Weight1
- 228.08
- CAS
- 16813-30-2
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -13.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -263.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.52 | kJ/mol | Joback Calculated Property |
| log10WS | -1.71 | Crippen Calculated Property | |
| logPoct/wat | 0.473 | Crippen Calculated Property | |
| McVol | 152.960 | ml/mol | McGowan Calculated Property |
| Pc | 3448.03 | kPa | Joback Calculated Property |
| Tboil | 669.79 | K | Joback Calculated Property |
| Tc | 872.36 | K | Joback Calculated Property |
| Tfus | 475.06 | K | Joback Calculated Property |
| Vc | 0.587 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [368.19; 414.30] | J/mol×K | [669.79; 872.36] | 
|
| Cp,gas | 368.19 | J/mol×K | 669.79 | Joback Calculated Property |
| Cp,gas | 377.28 | J/mol×K | 703.55 | Joback Calculated Property |
| Cp,gas | 385.77 | J/mol×K | 737.31 | Joback Calculated Property |
| Cp,gas | 393.70 | J/mol×K | 771.08 | Joback Calculated Property |
| Cp,gas | 401.09 | J/mol×K | 804.84 | Joback Calculated Property |
| Cp,gas | 407.94 | J/mol×K | 838.60 | Joback Calculated Property |
| Cp,gas | 414.30 | J/mol×K | 872.36 | Joback Calculated Property |
Similar Compounds
![Glycine, n-[(2-chloroethyl )carbamoyl]-, ethyl ester.](data:image/png;base64,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)
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