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CAS No.: | 62558-08-1 |
---|---|
Name: | [5-fluoro-2-(hydroxymethyl)phenyl]methanol |
Article Data: | 13 |
Molecular Structure: | |
Formula: | C8H9FO2 |
Molecular Weight: | 156.157 |
Synonyms: | 1,2-Bis(hydroxymethyl)-4-fluorobenzene;NSC 403012; |
Density: | 1.287 g/cm3 |
Boiling Point: | 288.6 °C at 760 mmHg |
Flash Point: | 128.3 °C |
PSA: | 40.46000 |
LogP: | 0.81030 |
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This chemical is called 1,2-Benzenedimethanol,4-fluoro-, and its systematic name is (4-fluorobenzene-1,2-diyl)dimethanol. With the molecular formula of C8H9FO2, its molecular weight is 156.154263. The CAS registry number of this chemical is 62558-08-1.
Other characteristics of the 1,2-Benzenedimethanol,4-fluoro- can be summarised as followings: (1)ACD/LogP: 0.07; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 18.46 Å2; (7)Index of Refraction: 1.558; (8)Molar Refractivity: 39.14 cm3; (9)Molar Volume: 121.2 cm3; (10)Polarizability: 15.51×10-24cm3; (11)Surface Tension: 49.3 dyne/cm; (12)Density: 1.287 g/cm3; (13)Flash Point: 128.3 °C; (14)Enthalpy of Vaporization: 55.75 kJ/mol; (15)Boiling Point: 288.6 °C at 760 mmHg; (16)Vapour Pressure: 0.00107 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Fc1cc(c(cc1)CO)CO
2.InChI: InChI=1/C8H9FO2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3,10-11H,4-5H2
3.InChIKey: VLSOAXRVHARBEQ-UHFFFAOYAH