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| CAS No.: | 13196-11-7 |
|---|---|
| Name: | 1-BENZOFURAN-6-OL |
| Article Data: | 12 |
| Molecular Structure: | |
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| Formula: | C8H6O2 |
| Molecular Weight: | 134.134 |
| Synonyms: | 6-Hydroxybenzo[b]furan;6-Hydroxybenzofuran; |
| Density: | 1.28 g/cm3 |
| Melting Point: | 108℃ |
| Boiling Point: | 110.7 °C at 760 mmHg |
| Flash Point: | 20.7 °C |
| PSA: | 33.37000 |
| LogP: | 2.13840 |
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- Total:36 Page 1 of 1 1
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Specification
The 6-Benzofuranol, with the CAS registry number 13196-11-7, is also known as 6-Hydroxybenzofuran. This chemical's molecular formula is C8H6O2 and molecular weight is 134.13204. Its systematic name is called 1-benzofuran-6-ol.
Physical properties of 6-Benzofuranol: (1)ACD/LogP: 1.93; (2)ACD/LogD (pH 5.5): 1.93; (3)ACD/LogD (pH 7.4): 1.93; (4)ACD/BCF (pH 5.5): 17.36; (5)ACD/BCF (pH 7.4): 17.09; (6)ACD/KOC (pH 5.5): 268.43; (7)ACD/KOC (pH 7.4): 264.32; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.651; (12)Molar Refractivity: 38.27 cm3; (13)Molar Volume: 104.7 cm3; (14)Surface Tension: 51 dyne/cm; (15)Density: 1.28 g/cm3; (16)Flash Point: 20.7 °C; (17)Enthalpy of Vaporization: 36.38 kJ/mol; (18)Boiling Point: 110.7 °C at 760 mmHg; (19)Vapour Pressure: 20 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc2ccc1c(occ1)c2
(2)InChI: InChI=1/C8H6O2/c9-7-2-1-6-3-4-10-8(6)5-7/h1-5,9H
(3)InChIKey: UVJMVWURCUYFFK-UHFFFAOYAZ