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2,3-Difluorobenzyl alcohol

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Name

2,3-Difluorobenzyl alcohol

EINECS N/A
CAS No. 75853-18-8 Density 1.29 g/cm3
PSA 20.23000 LogP 1.45710
Solubility Slightly soluble in water. Melting Point N/A
Formula C7H6F2O Boiling Point 195.2 °C at 760 mmHg
Molecular Weight 144.121 Flash Point 93.9 °C
Transport Information N/A Appearance Clear colorless to pale brown liquid
Safety 26-39-37/39 Risk Codes 41-36/37/38
Molecular Structure Molecular Structure of 75853-18-8 (2,3-Difluorobenzyl alcohol) Hazard Symbols IrritantXi
Synonyms

(2,3-Difluorophenyl)methanol;(2,3-Difluorophenyl)methan-1-ol;2,3-Difluoro benzylalcohol;AC1Q7BXL;AC1L9KJ4;

Article Data 1

2,3-Difluorobenzyl alcohol Specification

The 2,3-Difluorobenzyl alcohol with CAS registry number of 75853-18-8 is also known as Benzenemethanol,2,3-difluoro-. The IUPAC name is (2,3-Difluorophenyl)methanol. It belongs to product categories of Benzhydrols, Benzyl & Special Alcohols; Aromatic Compound; Miscellaneous; Alcohols; C7 to C8; Oxygen Compounds. In addition, the formula is C7H6F2O and the molecular weight is 144.12. This chemical is a clear colorless to pale brown liquid that may cause inflammation to the skin or other mucous membranes. What's more, it should be sealed in cool and dry place away from oxidants.

Physical properties about 2,3-Difluorobenzyl alcohol are: (1)ACD/LogP: 1.05; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Index of Refraction: 1.497; (7)Molar Refractivity: 32.69 cm3; (8)Molar Volume: 111.6 cm3; (9)Surface Tension: 36.8 dyne/cm; (10)Density: 1.29 g/cm3; (11)Flash Point: 93.9 °C; (12)Enthalpy of Vaporization: 45.61 kJ/mol; (13)Boiling Point: 195.2 °C at 760 mmHg; (14)Vapour Pressure: 0.265 mmHg at 25 °C.

Preparation of 2,3-Difluorobenzyl alcohol: it is prepared by reaction of 2,3-Difluorobenzoic acid. The reaction needs reagent B2H6 and solvent tetrahydrofuran for 1.5 hours. The yield is about 40%.

2,3-Difluorobenzyl alcohol is prepared by reaction of 2,3-Difluorobenzoic acid.

Uses of 2,3-Difluorobenzyl alcohol: it is used to produce 1-bromomethyl-2,3-difluoro-benzene. The reaction occurs with reagent PBr3 and solvent toluene at the temperature of 100 °C for 1 hour. The yield is about 61%.

2,3-Difluorobenzyl alcohol is used to produce 1-bromomethyl-2,3-difluoro-benzene

When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes, respiratory system and skin. Besides, there is risk of serious damage to eyes. During using it, wear suitable gloves and eye/face protection. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: C1=CC(=C(C(=C1)F)F)CO
2. InChI: InChI=1S/C7H6F2O/c8-6-3-1-2-5(4-10)7(6)9/h1-3,10H,4H2
3. InChIKey: JSFGDUIJQWWBGY-UHFFFAOYSA-N

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