2-Methoxy-4-trifluoromethylphenylboronic acid supplier

Name
2-METHOXY-4-(TRIFLUOROMETHYL)-PHENYLBORONIC ACID
EINECS
CAS No. 312936-89-3
Article Data3
CAS DataBase
Density 1.36 g/cm³
Solubility
Melting Point
Formula C₈H₈BF₃O₃
Boiling Point 309.9 °C at 760 mmHg
Molecular Weight 219.956
Flash Point 141.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Boronicacid, [2-methoxy-4-(trifluoromethyl)phenyl]- (9CI);
PSA 49.69000
LogP 0.39380

2-Methoxy-4-trifluoromethylphenylboronic acid Specification

The CAS register number of Boronic acid,B-[2-methoxy-4-(trifluoromethyl)phenyl]- is 312936-89-3. It also can be called as 2-Methoxy-4-(trifluoromethyl)benzeneboronic acid and the systematic name about this chemical is [2-methoxy-4-(trifluoromethyl)phenyl]boronic acid. The molecular formula about this chemical is C₈H₈BF₃O₃ and the molecular weight is 219.95.

Physical properties about Boronic acid,B-[2-methoxy-4-(trifluoromethyl)phenyl]- are: (1)ACD/LogP: 2.57; (2)ACD/LogD (pH 5.5): 2.56; (3)ACD/LogD (pH 7.4): 2.43; (4)#H bond acceptors: 3; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 4; (7)Polar Surface Area: 49.69Å²; (8)Index of Refraction: 1.464; (9)Molar Refractivity: 44.64 cm³; (10)Molar Volume: 161.5 cm³; (11)Polarizability: 17.69x10^-24cm³; (12)Surface Tension: 34.7 dyne/cm; (13)Flash Point: 141.2 °C; (14)Enthalpy of Vaporization: 58.15 kJ/mol; (15)Boiling Point: 309.9 °C at 760 mmHg; (16)Vapour Pressure: 0.000267 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1cc(ccc1B(O)O)C(F)(F)F
(2)InChI: InChI=1/C8H8BF3O3/c1-15-7-4-5(8(10,11)12)2-3-6(7)9(13)14/h2-4,13-14H,1H3
(3)InChIKey: UCNRYDKUBYQIOW-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C8H8BF3O3/c1-15-7-4-5(8(10,11)12)2-3-6(7)9(13)14/h2-4,13-14H,1H3
(5)Std. InChIKey: UCNRYDKUBYQIOW-UHFFFAOYSA-N

Product Name

2-METHOXY-4-(TRIFLUOROMETHYL)-PHENYLBORONIC ACID

2-Methoxy-4-trifluoromethylphenylboronic acid Specification

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