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| CAS No.: | 261763-29-5 |
|---|---|
| Name: | Phenol, 2,3-difluoro-4-methoxy- |
| Article Data: | 2 |
| Cas Database | |
| Molecular Structure: | |
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| Formula: | C7H6F2O2 |
| Molecular Weight: | 160.12 |
| Synonyms: | 2,3-Difluoro-4-hydroxyanisole; 1-Hydroxy-4-methoxy-2,3-difluorobenzene; 2,3-Difluoro-4-methoxyphenol; |
| EINECS: | N/A |
| Density: | 1.331 g/cm3 |
| Melting Point: | -49°C |
| Boiling Point: | 217.894 °C at 760 mmHg |
| Flash Point: | 108.438 °C |
| Solubility: | N/A |
| Appearance: | N/A |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 25 |
| Safety: | 45 |
| Transport Information: | N/A |
| PSA: | 29.46000 |
| LogP: | 1.67900 |
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This chemical is called Phenol, 2,3-difluoro-4-methoxy-, and its systematic name is 2,3-difluoro-4-methoxyphenol. With the molecular formula of C7H6F2O2, its molecular weight is 160.12 . The CAS registry number of this chemical is 261763-29-5. Additionally, its product categories are Halide; Methoxy.
Other characteristics of the Phenol, 2,3-difluoro-4-methoxy- can be summarised as followings: (1)ACD/LogP: 1.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.89; (4)ACD/LogD (pH 7.4): 1.83; (5)ACD/BCF (pH 5.5): 16.21; (6)ACD/BCF (pH 7.4): 14.09; (7)ACD/KOC (pH 5.5): 255.43; (8)ACD/KOC (pH 7.4): 222.01; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.49; (14)Molar Refractivity: 34.8 cm3; (15)Molar Volume: 120.2 cm3; (16)Polarizability: 13.79×10-24cm3; (17)Surface Tension: 35.3 dyne/cm; (18)Density: 1.331 g/cm3; (19)Flash Point: 108.4 °C; (20)Enthalpy of Vaporization: 47.28 kJ/mol; (21)Boiling Point: 217.9 °C at 760 mmHg; (22)Vapour Pressure: 0.088 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Fc1c(F)c(O)ccc1OC
2.InChI: InChI=1/C7H6F2O2/c1-11-5-3-2-4(10)6(8)7(5)9/h2-3,10H,1H3
3.InChIKey: CKKAZWYLHGNVDZ-UHFFFAOYAK
