5-Methoxy-2-(trifluoromethyl)benzaldehyde supplier

Name
5-Methoxy-2-(trifluoroMethyl)benzaldehyde
EINECS
CAS No. 944905-42-4
Density 1.287 g/cm³
Solubility
Melting Point
Formula C₉H₇F₃O₂
Boiling Point 254.315 °C at 760 mmHg
Molecular Weight 204.149
Flash Point 104.473 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms CL9056;
PSA 26.30000
LogP 2.52650

5-Methoxy-2-(trifluoromethyl)benzaldehyde Specification

The 5-Methoxy-2-(trifluoromethyl)benzaldehyde, with the CAS registry number 944905-42-4, is also known as Benzaldehyde, 5-methoxy-2-(trifluoromethyl)-. This chemical's molecular formula is C₉H₇F₃O₂ and molecular weight is 204.15. What's more, its systematic name is 5-Methoxy-2-(trifluoromethyl)benzaldehyde.

Physical properties of 5-Methoxy-2-(trifluoromethyl)benzaldehyde are: (1)ACD/LogP: 3.309; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.31; (4)ACD/LogD (pH 7.4): 3.31; (5)ACD/BCF (pH 5.5): 192.80; (6)ACD/BCF (pH 7.4): 192.80; (7)ACD/KOC (pH 5.5): 1504.15; (8)ACD/KOC (pH 7.4): 1504.15; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.475; (14)Molar Refractivity: 44.664 cm³; (15)Molar Volume: 158.612 cm³; (16)Polarizability: 17.706×10^-24cm³; (17)Surface Tension: 28.4 dyne/cm; (18)Density: 1.287 g/cm³; (19)Flash Point: 104.473 °C; (20)Enthalpy of Vaporization: 49.174 kJ/mol; (21)Boiling Point: 254.315 °C at 760 mmHg; (22)Vapour Pressure: 0.02 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1ccc(c(c1)C=O)C(F)(F)F
(2)Std. InChI: InChI=1S/C9H7F3O2/c1-14-7-2-3-8(9(10,11)12)6(4-7)5-13/h2-5H,1H3
(3)Std. InChIKey: QFKMLBPPJRRDBX-UHFFFAOYSA-N

Product Name

5-Methoxy-2-(trifluoroMethyl)benzaldehyde

5-Methoxy-2-(trifluoromethyl)benzaldehyde Specification

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