(2-Trifluoromethyl-pyridin-4-yl)-methanol supplier

Name
(2-Trifluoromethyl-pyridin-4-yl)-methanol
EINECS
CAS No. 131747-61-0
Article Data8
CAS DataBase
Density 1.362 g/cm³
Solubility
Melting Point
Formula C₇H₆F₃NO
Boiling Point 212.6 °C at 760 mmHg
Molecular Weight 177.126
Flash Point 82.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Pyridinemethanol, 2-(trifluoromethyl)-;
PSA 33.12000
LogP 1.59270

(2-Trifluoromethyl-pyridin-4-yl)-methanol Specification

The (2-Trifluoromethyl-pyridin-4-yl)-methanol has CAS registry number 131747-61-0. This chemical's molecular formula is C₇H₆F₃NO and molecular weight is 177.1238. What's more, its IUPAC name is [2-(Trifluoromethyl)pyridin-4-yl]methanol.

Physical properties about (2-Trifluoromethyl-pyridin-4-yl)-methanol are: (1)ACD/LogP: 0.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.11; (4)ACD/LogD (pH 7.4): 0.11; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 27.48; (8)ACD/KOC (pH 7.4): 27.48; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 22.12 Å²; (13)Index of Refraction: 1.462; (14)Molar Refractivity: 35.77 cm³; (15)Molar Volume: 129.9 cm³; (16)Polarizability: 14.18×10^-24 cm³; (17)Surface Tension: 33.2 dyne/cm; (18)Density: 1.362 g/cm³; (19)Flash Point: 82.4 °C; (20)Enthalpy of Vaporization: 47.45 kJ/mol; (21)Boiling Point: 212.6 °C at 760 mmHg; (22)Vapour Pressure: 0.102 mmHg at 25 °C.

Uses of (2-Trifluoromethyl-pyridin-4-yl)-methanol: it is used to produce other chemicals. For example, it is used to produce 2-Trifluoromethyl-pyridine-4-carbaldehyde at ambient temperature. This reaction needs reagents DMSO, N, N'-Dicyclohexylcarbodiimide and H₃PO₄. The reaction time is 1.5 hours. The yield is about 69 %.

(2-Trifluoromethyl-pyridin-4-yl)-methanol can be used to produce 2-Trifluoromethyl-pyridine-4-carbaldehyde.

You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(F)c1nccc(c1)CO
(2) InChI: InChI=1/C7H6F3NO/c8-7(9,10)6-3-5(4-12)1-2-11-6/h1-3,12H,4H2
(3) InChIKey: UOQWDROTEICSEX-UHFFFAOYAZ

Product Name

(2-Trifluoromethyl-pyridin-4-yl)-methanol

(2-Trifluoromethyl-pyridin-4-yl)-methanol Specification

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