CAS No.2882-19-1,ETHYL ALPHA-BROMOPHENYLACETATE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	2882-19-1
Name:	ETHYL ALPHA-BROMOPHENYLACETATE
Article Data:	60

Formula:	C₁₀H₁₁BrO₂
Molecular Weight:	243.1
Synonyms:	Aceticacid, bromophenyl-, ethyl ester (6CI,7CI,8CI);2-Bromo-2-phenylacetic acidethyl ester;DL-a-Bromophenylaceticacid ethyl ester;Ethyl 2-bromo-2-phenylacetate;Ethyl 2-bromophenylacetate;a-Bromophenylacetic acid ethylester;Ethyl a-bromo-a-phenylacetate;Ethyl a-bromobenzeneacetate;Ethyl a-bromophenylacetate;NSC 38807;a-Bromobenzeneacetic acid ethylester;
EINECS:	220-735-2
Density:	1.407 g/cm³
Boiling Point:	268.4 °C at 760 mmHg
Flash Point:	116.1 °C
Solubility:	Not miscible or difficult to mix in water.
Hazard Symbols:	C
Risk Codes:	34
Safety:	26-36/37/39-45
Transport Information:	UN 3265 8/PG 2
PSA:	26.30000
LogP:	2.68570

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Specification

The Benzeneacetic acid, a-bromo-, ethyl ester with CAS registry number of 2882-19-1 is also known as Ethyl bromophenylacetate. The IUPAC name is Ethyl 2-bromo-2-phenylacetate. It belongs to product categories of Pharmaceutical Intermediates; Esters; Phenyls & Phenyl-Het; C10 to C11; Carbonyl Compounds. Its EINECS registry number is 220-735-2. In addition, the formula is C₁₀H₁₁BrO₂ and the molecular weight is 243.10. This chemical may destroy living tissue on contact and should be sealed in cool, dry place.

Physical properties about Benzeneacetic acid, a-bromo-, ethyl ester are: (1)ACD/LogP: 3.35; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.35; (4)ACD/LogD (pH 7.4): 3.35; (5)ACD/BCF (pH 5.5): 208.47; (6)ACD/BCF (pH 7.4): 208.47; (7)ACD/KOC (pH 5.5): 1590.68; (8)ACD/KOC (pH 7.4): 1590.68; (9)#H bond acceptors: 2; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.544; (12)Molar Refractivity: 54.57 cm³; (13)Molar Volume: 172.6 cm³; (14)Surface Tension: 41.7 dyne/cm; (15)Density: 1.407 g/cm³; (16)Flash Point: 116.1 °C; (17)Enthalpy of Vaporization: 50.65 kJ/mol; (18)Boiling Point: 268.4 °C at 760 mmHg; (19)Vapour Pressure: 0.0077 mmHg at 25 °C.

Preparation of Benzeneacetic acid, a-bromo-, ethyl ester: it is prepared by reaction of bromo-phenyl-acetic acid with ethanol. The reaction needs reagent p-TsOH monohydrate other condition of heating for 5 hours. The yield is about 84%.

Benzeneacetic acid, a-bromo-, ethyl ester is prepared by reaction of bromo-phenyl-acetic acid with ethanol.

Uses of Benzeneacetic acid, a-bromo-, ethyl ester: it is used to produce dimethylamino-phenyl-acetic acid ethyl ester by reaction with dimethylamine. The reaction occurs with solvents tetrahydrofuran, H₂O and other condition of ambient temperature for 24 hours. The yield is about 92%.

Benzeneacetic acid, a-bromo-, ethyl ester is used to produce dimethylamino-phenyl-acetic acid ethyl ester by reaction with dimethylamine.

When you are using this chemical, please be cautious about it. As a chemical, it causes burns. During using it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell seek medical advice immediately.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: CCOC(=O)C(C1=CC=CC=C1)Br
2. InChI: InChI=1S/C10H11BrO2/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3
3. InChIKey: BKTKLDMYHTUESO-UHFFFAOYSA-N