Ethyl 2-(3-bromophenyl)-2-oxoacetate supplier

Name
ETHYL 3-BROMOBENZOYL FORMATE
EINECS
CAS No. 62123-80-2
Article Data3
CAS DataBase
Density 1.48 g/cm³
Solubility
Melting Point
Formula C₁₀H₉BrO₃
Boiling Point 323.6 °C at 760 mmHg
Molecular Weight 257.084
Flash Point 149.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Ethyl 3-bromobenzoyl formate;
PSA 43.37000
LogP 2.19490

Ethyl 2-(3-bromophenyl)-2-oxoacetate Specification

The Ethyl 2-(3-bromophenyl)-2-oxoacetate, with the CAS registry number 62123-80-2, is also known as Ethyl 3-bromobenzoyl formate. This chemical's molecular formula is C₁₀H₉BrO₃ and molecular weight is 257.08. What's more, its systematic name is Ethyl 2-(3-bromophenyl)-2-oxo-acetate.

Physical properties about Ethyl 2-(3-bromophenyl)-2-oxoacetate are: (1)ACD/LogP: 2.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.77; (4)ACD/LogD (pH 7.4): 2.77; (5)#H bond acceptors: 3; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 4; (8)Polar Surface Area: 43.37 Å²; (9)Index of Refraction: 1.546; (10)Molar Refractivity: 55.01 cm³; (11)Molar Volume: 173.6 cm³; (12)Polarizability: 21.8×10^-24 cm³; (13)Surface Tension: 44 dyne/cm; (14)Density: 1.48 g/cm³; (15)Flash Point: 149.5 °C; (16)Enthalpy of Vaporization: 56.55 kJ/mol; (17)Boiling Point: 323.6 °C at 760 mmHg; (18)Vapour Pressure: 0.00026 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1cc(Br)ccc1)C(=O)OCC
(2) InChI: InChI=1/C10H9BrO3/c1-2-14-10(13)9(12)7-4-3-5-8(11)6-7/h3-6H,2H2,1H3
(3) InChIKey: SVPWKTIUMGLHFL-UHFFFAOYAG

Product Name

ETHYL 3-BROMOBENZOYL FORMATE

Ethyl 2-(3-bromophenyl)-2-oxoacetate Specification

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