CAS No.57486-69-8,METHYL 2-(2-BROMOPHENYL)ACETATE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	57486-69-8
Name:	METHYL 2-(2-BROMOPHENYL)ACETATE
Article Data:	54

Formula:	C₉H₉BrO₂
Molecular Weight:	229.073
Synonyms:	(2-Bromophenyl)aceticacid methyl ester;2-Bromobenzeneacetic acid methyl ester;Methyl(2-bromophenyl)acetate;Methyl o-bromophenylacetate;
Density:	1.445 g/cm³
Boiling Point:	264.073 °C at 760 mmHg
Flash Point:	113.508 °C
Hazard Symbols:	Xi
PSA:	26.30000
LogP:	2.16460

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Specification

The CAS register number of Benzeneacetic acid,2-bromo-, methyl ester is 57486-69-8. It also can be called as 2-Bromobenzeneacetic acid methyl ester and the systematic name about this chemical is methyl (2-bromophenyl)acetate. The molecular formula about this chemical is C₉H₉BrO₂ and the molecular weight is 229.07. It belongs to the following product categories which include Blocks; Bromides; Carboxes; Aromatic Building Blocks and so on.

Physical properties about Benzeneacetic acid,2-bromo-, methyl ester are: (1)ACD/LogP: 2.68; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 71; (5)ACD/BCF (pH 7.4): 71; (6)ACD/KOC (pH 5.5): 735; (7)ACD/KOC (pH 7.4): 735; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 26.3Å²; (11)Index of Refraction: 1.543; (12)Molar Refractivity: 49.9 cm³; (13)Molar Volume: 158.424 cm³; (14)Polarizability: 19.782x10^-24cm³; (15)Surface Tension: 40.187 dyne/cm; (16)Enthalpy of Vaporization: 50.193 kJ/mol; (17)Boiling Point: 264.073 °C at 760 mmHg; (18)Vapour Pressure: 0.01 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccccc1CC(=O)OC
(2)InChI: InChI=1/C9H9BrO2/c1-12-9(11)6-7-4-2-3-5-8(7)10/h2-5H,6H2,1H3
(3)InChIKey: AMVCFIFDMKEIRE-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C9H9BrO2/c1-12-9(11)6-7-4-2-3-5-8(7)10/h2-5H,6H2,1H3
(5)Std. InChIKey: AMVCFIFDMKEIRE-UHFFFAOYSA-N