- InChI
- InChI=1S/C14H8Cl2O3/c15-11-5-1-3-9(7-11)13(17)19-14(18)10-4-2-6-12(16)8-10/h1-8H
- InChI Key
- NIHKFGMYMWGERR-UHFFFAOYSA-N
- Formula
- C14H8Cl2O3
- SMILES
-
O=C(OC(=O)c1cccc(Cl)c1)c1cccc(
Cl)c1 - Molecular Weight1
- 295.12
- CAS
- 30070-63-4
- Other Names
-
- 3-Chlorobenzoic anhydride
- 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).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- 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° | -114.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -271.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.31 | kJ/mol | Joback Calculated Property |
| log10WS | -5.05 | Crippen Calculated Property | |
| logPoct/wat | 3.991 | Crippen Calculated Property | |
| McVol | 194.090 | ml/mol | McGowan Calculated Property |
| Pc | 2784.72 | kPa | Joback Calculated Property |
| Inp | 2269.70 | NIST | |
| Tboil | 788.06 | K | Joback Calculated Property |
| Tc | 1041.94 | K | Joback Calculated Property |
| Tfus | 507.35 | K | Joback Calculated Property |
| Vc | 0.732 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [469.63; 516.96] | J/mol×K | [788.06; 1041.94] | 
|
| Cp,gas | 469.63 | J/mol×K | 788.06 | Joback Calculated Property |
| Cp,gas | 480.10 | J/mol×K | 830.37 | Joback Calculated Property |
| Cp,gas | 489.47 | J/mol×K | 872.69 | Joback Calculated Property |
| Cp,gas | 497.80 | J/mol×K | 915.00 | Joback Calculated Property |
| Cp,gas | 505.12 | J/mol×K | 957.31 | Joback Calculated Property |
| Cp,gas | 511.50 | J/mol×K | 999.63 | Joback Calculated Property |
| Cp,gas | 516.96 | J/mol×K | 1041.94 | Joback Calculated Property |
| η | [0.0001284; 0.0007691] | Pa×s | [507.35; 788.06] |
|
| η | 0.0007691 | Pa×s | 507.35 | Joback Calculated Property |
| η | 0.0005031 | Pa×s | 554.13 | Joback Calculated Property |
| η | 0.0003516 | Pa×s | 600.92 | Joback Calculated Property |
| η | 0.0002588 | Pa×s | 647.70 | Joback Calculated Property |
| η | 0.0001985 | Pa×s | 694.49 | Joback Calculated Property |
| η | 0.0001574 | Pa×s | 741.27 | Joback Calculated Property |
| η | 0.0001284 | Pa×s | 788.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzoic acid, 3-chloro-, anhydride.
Sources
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