- InChI
- InChI=1S/C3H5Br2Cl/c4-1-3(5)2-6/h3H,1-2H2
- InChI Key
- WBEJYOJJBDISQU-UHFFFAOYSA-N
- Formula
- C3H5Br2Cl
- SMILES
- ClCC(Br)CBr
- Molecular Weight1
- 236.33
- CAS
- 96-12-8
- Other Names
-
- 1,2-Dibrom-3-chlor-propan
- 1,2-Dibromo-3-cloro-propano
- 1,2-Dibroom-3-chloorpropaan
- 1,2-dibromo-3-chloropropane
- 1,2-dibromo-3-chloropropane (DBCP)
- 1-chloro-2,3-dibromopropane
- 3-chloro-1,2-dibromopropane
- BBC 12
- ClCH2CHBrCH2Br
- DBCP
- Dibromchlorpropan
- Dibromochloropropane
- Fumagon
- Fumazone
- Fumazone 86
- Fumazone 86E
- NCI-C00500
- NSC 1512
- Nemabrom
- Nemafume
- Nemagon
- Nemagon 20
- Nemagon 20G
- Nemagon 90
- Nemagon Soil Fumigant
- Nemanax
- Nemapaz
- Nemaset
- Nemazon
- OS 1897
- Propane, 1-chloro-2,3-dibromo-
- SD 1897
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -89.01 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.24 | kJ/mol | Relay (1.0) Calculated Property |
| log10WS | -2.38 | Aq. Solubility Prediction | |
| logPoct/wat | 2.384 | Crippen Calculated Property | |
| McVol | 100.370 | ml/mol | McGowan Calculated Property |
| Inp | [1033.90; 1100.14] |
|
|
| Inp | 1089.72 | NIST | |
| Inp | 1100.14 | NIST | |
| Inp | 1092.41 | NIST | |
| Inp | 1095.64 | NIST | |
| Inp | 1033.90 | NIST | |
| Inp | 1036.00 | NIST | |
| Inp | 1063.00 | NIST | |
| I | [1657.00; 1657.00] |
|
|
| I | 1657.00 | NIST | |
| I | 1657.00 | NIST | |
| Tboil | 457.12 | K | Relay (1.0) Calculated Property |
| Tfus | 261.04 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [143.03; 172.97] | J/mol×K | [437.55; 659.19] |
|
| Cp,gas | 143.03 | J/mol×K | 437.55 | Joback Calculated Property |
| Cp,gas | 149.02 | J/mol×K | 474.49 | Joback Calculated Property |
| Cp,gas | 154.57 | J/mol×K | 511.43 | Joback Calculated Property |
| Cp,gas | 159.71 | J/mol×K | 548.37 | Joback Calculated Property |
| Cp,gas | 164.47 | J/mol×K | 585.31 | Joback Calculated Property |
| Cp,gas | 168.88 | J/mol×K | 622.25 | Joback Calculated Property |
| Cp,gas | 172.97 | J/mol×K | 659.19 | Joback Calculated Property |
| η | [0.0004515; 0.0039928] | Pa×s | [258.09; 437.55] |
|
| η | 0.0039928 | Pa×s | 258.09 | Joback Calculated Property |
| η | 0.0022992 | Pa×s | 288.00 | Joback Calculated Property |
| η | 0.0014689 | Pa×s | 317.91 | Joback Calculated Property |
| η | 0.0010136 | Pa×s | 347.82 | Joback Calculated Property |
| η | 0.0007417 | Pa×s | 377.73 | Joback Calculated Property |
| η | 0.0005682 | Pa×s | 407.64 | Joback Calculated Property |
| η | 0.0004515 | Pa×s | 437.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propane, 1,2-dibromo-3-chloro-.
Mixtures
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Determination of Henry's Law Constants Using Internal Standards with Benchmark Values
- Joback Method
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
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