Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

4-Bromo-2-(trifluoromethoxy)benzoic acid methyl ester

Related Products

Hot Products

Name

4-Bromo-2-(trifluoromethoxy)benzoic acid methyl ester

EINECS 1533716-785-6
CAS No. 933785-18-3 Density 1.626 g/cm3
PSA 35.53000 LogP 3.13430
Solubility N/A Melting Point N/A
Formula C9H6BrF3O3 Boiling Point 265.9 °C at 760 mmHg
Molecular Weight 299.044 Flash Point 114.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 933785-18-3 (Ethyl 4-bromo-2-(trifluoromethoxy)benzoate) Hazard Symbols N/A
Synonyms

methyl 4-bromo-2-(trifluoromethoxy)benzoate;benzoic acid, 4-bromo-2-(trifluoromethoxy)-, methyl ester;

Article Data 3

4-Bromo-2-(trifluoromethoxy)benzoic acid methyl ester Specification

The Ethyl 4-bromo-2-(trifluoromethoxy)benzoate, with the CAS registry number 933785-18-3, is also called benzoic acid, 4-bromo-2-(trifluoromethoxy)-, methyl ester. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C9H6BrF3O3.

The characteristics of Ethyl 4-bromo-2-(trifluoromethoxy)benzoate are as followings: (1)ACD/LogP: 3.95; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.95; (4)ACD/LogD (pH 7.4): 3.95; (5)ACD/BCF (pH 5.5): 589.91; (6)ACD/BCF (pH 7.4): 589.91; (7)ACD/KOC (pH 5.5): 3349.12; (8)ACD/KOC (pH 7.4): 3349.12; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 35.53 Å2; (13)Index of Refraction: 1.486; (14)Molar Refractivity: 52.85 cm3; (15)Molar Volume: 183.9 cm3; (16)Polarizability: 20.95×10-24cm3; (17)Surface Tension: 33.6 dyne/cm; (18)Density: 1.626 g/cm3; (19)Flash Point: 114.6 °C; (20)Enthalpy of Vaporization: 50.39 kJ/mol; (21)Boiling Point: 265.9 °C at 760 mmHg; (22)Vapour Pressure: 0.0089 mmHg at 25°C.     

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OC)c1c(OC(F)(F)F)cc(Br)cc1
(2)InChI: InChI=1/C9H6BrF3O3/c1-15-8(14)6-3-2-5(10)4-7(6)16-9(11,12)13/h2-4H,1H3
(3)InChIKey: QWWIUYXPVVJVNS-UHFFFAOYAI

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 933785-18-3