- InChI
- InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3
- InChI Key
- WJGPNUBJBMCRQH-UHFFFAOYSA-N
- Formula
- C10H12O2
- SMILES
- CC1(C)Cc2cccc(O)c2O1
- Molecular Weight1
- 164.20
- CAS
- 1563-38-8
- Other Names
-
- Carbofuran phenol
- Nia 10272
- 2,3-Dihydro-2,2-dimethyl-7-benzofuranol
- 2,3-Dihydro-2,2-dimethyl-7-hydroxybenzofuran
- Carbofuran 7-phenol
- Carbofuran-7-ol
- 2,3-dihydro-2,2-dimethylbenzofuran-7-ol
- 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).
- 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° | -49.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -245.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.08 | kJ/mol | Joback Calculated Property |
| log10WS | -2.37 | Crippen Calculated Property | |
| logPoct/wat | 2.106 | Crippen Calculated Property | |
| McVol | 128.880 | ml/mol | McGowan Calculated Property |
| Pc | 4178.49 | kPa | Joback Calculated Property |
| Inp | [1292.00; 1294.00] |
|
|
| Inp | 1294.00 | NIST | |
| Inp | 1292.00 | NIST | |
| Inp | 1292.00 | NIST | |
| Tboil | 574.41 | K | Joback Calculated Property |
| Tc | 818.22 | K | Joback Calculated Property |
| Tfus | 421.53 | K | Joback Calculated Property |
| Vc | 0.429 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [323.41; 390.50] | J/mol×K | [574.41; 818.22] |
|
| Cp,gas | 323.41 | J/mol×K | 574.41 | Joback Calculated Property |
| Cp,gas | 336.36 | J/mol×K | 615.05 | Joback Calculated Property |
| Cp,gas | 348.27 | J/mol×K | 655.68 | Joback Calculated Property |
| Cp,gas | 359.38 | J/mol×K | 696.32 | Joback Calculated Property |
| Cp,gas | 369.96 | J/mol×K | 736.95 | Joback Calculated Property |
| Cp,gas | 380.24 | J/mol×K | 777.59 | Joback Calculated Property |
| Cp,gas | 390.50 | J/mol×K | 818.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 7-Benzofuranol, 2,3-dihydro-2,2-dimethyl-.
Sources
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