- InChI
- InChI=1S/C3H4Cl2/c4-2-1-3-5/h1-2H,3H2
- InChI Key
- UOORRWUZONOOLO-UHFFFAOYSA-N
- Formula
- C3H4Cl2
- SMILES
- ClC=CCCl
- Molecular Weight1
- 110.97
- CAS
- 542-75-6
- Other Names
-
- 1,3-D
- 1,3-DICHLORO-2-PROPENE
- 1,3-DICHLOROPROPENE
- 1,3-DICHLOROPROPYLENE
- 1,3-Dichloro-1-propene
- 1,3-Dichloro-1-propene,c&t
- 1,3-Dichloropropene,c&t
- 1,3-Dichloropropene-1
- 1,3-Dichlorpropene
- 3-Chloroallyl chloride
- 3-Chloropropenyl chloride
- D-D92
- D-D95
- Dedisol C
- Dorlone II
- NCI-C03985
- NSC 6202
- Nemex
- Propene, 1,3-dichloro-
- Telone
- Telone 2000
- Telone C
- Telone II
- Telone II-B
- «alpha»,«gamma»-Dichloropropylene
- «gamma»-Chloroallyl chloride
- «alpha»,«gamma»-Dichloropropylene
- «gamma»-Chloroallyl chloride
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- NFPA Fire : NFPA Fire Rating.
- NFPA Health : NFPA Health Rating.
- Pc : Critical Pressure (kPa).
- Pvap : Vapor 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 |
|---|---|---|---|
| ΔfG° | 30.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -19.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 12.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 31.00 | kJ/mol | Joback Calculated Property |
| log10WS | -1.73 | Crippen Calculated Property | |
| logPoct/wat | 1.978 | Crippen Calculated Property | |
| McVol | 73.310 | ml/mol | McGowan Calculated Property |
| NFPA Fire | 3 | KDB | |
| NFPA Health | 2 | KDB | |
| Pc | 4283.05 | kPa | Joback Calculated Property |
| Tboil | 347.06 | K | Joback Calculated Property |
| Tc | 539.68 | K | Joback Calculated Property |
| Tfus | 178.33 | K | Joback Calculated Property |
| Vc | 0.281 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [95.61; 122.99] | J/mol×K | [347.06; 539.68] | 
|
| Cp,gas | 95.61 | J/mol×K | 347.06 | Joback Calculated Property |
| Cp,gas | 100.95 | J/mol×K | 379.16 | Joback Calculated Property |
| Cp,gas | 105.95 | J/mol×K | 411.27 | Joback Calculated Property |
| Cp,gas | 110.64 | J/mol×K | 443.37 | Joback Calculated Property |
| Cp,gas | 115.03 | J/mol×K | 475.47 | Joback Calculated Property |
| Cp,gas | 119.14 | J/mol×K | 507.58 | Joback Calculated Property |
| Cp,gas | 122.99 | J/mol×K | 539.68 | Joback Calculated Property |
| η | [0.0002812; 0.0033771] | Pa×s | [178.33; 347.06] |
|
| η | 0.0033771 | Pa×s | 178.33 | Joback Calculated Property |
| η | 0.0016830 | Pa×s | 206.45 | Joback Calculated Property |
| η | 0.0009911 | Pa×s | 234.57 | Joback Calculated Property |
| η | 0.0006537 | Pa×s | 262.69 | Joback Calculated Property |
| η | 0.0004674 | Pa×s | 290.82 | Joback Calculated Property |
| η | 0.0003545 | Pa×s | 318.94 | Joback Calculated Property |
| η | 0.0002812 | Pa×s | 347.06 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 378.70 | K | 97.30 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [284.52; 403.83] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.53145e+01 | |||
| Coefficient B | -3.56964e+03 | |||
| Coefficient C | -4.69710e+01 | |||
| Temperature range, min. | 284.52 | |||
| Temperature range, max. | 403.83 | |||
| Pvap | 1.33 | kPa | 284.52 | Calculated Property |
| Pvap | 2.95 | kPa | 297.78 | Calculated Property |
| Pvap | 6.03 | kPa | 311.03 | Calculated Property |
| Pvap | 11.50 | kPa | 324.29 | Calculated Property |
| Pvap | 20.69 | kPa | 337.55 | Calculated Property |
| Pvap | 35.37 | kPa | 350.80 | Calculated Property |
| Pvap | 57.80 | kPa | 364.06 | Calculated Property |
| Pvap | 90.81 | kPa | 377.32 | Calculated Property |
| Pvap | 137.78 | kPa | 390.57 | Calculated Property |
| Pvap | 202.67 | kPa | 403.83 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Propene, 1,3-dichloro-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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