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19381-40-9

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Basic Information
CAS No.: 19381-40-9
Name: 2-bromo-1-[3-(phenylmethoxy)phenyl]ethan-1-one
Article Data: 11
Molecular Structure:
Molecular Structure of 19381-40-9 (2-bromo-1-[3-(phenylmethoxy)phenyl]ethan-1-one)
Formula: C15H13BrO2
Molecular Weight: 305.171
Synonyms: Acetophenone,3'-(benzyloxy)-2-bromo- (8CI);2-(3-Benzyloxyphenyl)-2-oxoethyl bromide;2-Bromo-1-(3-benzyloxyphenyl)ethanone;2-Bromo-3'-benzyloxyacetophenone;3-Benzyloxyphenacyl bromide;m-(Benzyloxy)phenacyl bromide;
EINECS: 243-009-7
Density: 1.394 g/cm3
Boiling Point: 395.5 °C at 760 mmHg
Flash Point: 193 °C
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Specification

The Ethanone,2-bromo-1-[3-(phenylmethoxy)phenyl]-, with the CAS registry number 19381-40-9, is also known as 1-[3-(Benzyloxy)phenyl]-2-bromoethanone. Its EINECS registry number is 243-009-7. This chemical's molecular formula is C15H13BrO2 and molecular weight is 305.16652. Its IUPAC name is called 2-bromo-1-(3-phenylmethoxyphenyl)ethanone.

Physical properties of Ethanone,2-bromo-1-[3-(phenylmethoxy)phenyl]-: (1)ACD/LogP: 4.02; (2)ACD/LogD (pH 5.5): 4.02; (3)ACD/LogD (pH 7.4): 4.02; (4)ACD/BCF (pH 5.5): 669.73; (5)ACD/BCF (pH 7.4): 669.73; (6)ACD/KOC (pH 5.5): 3667.59; (7)ACD/KOC (pH 7.4): 3667.59; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 5; (10)Index of Refraction: 1.603; (11)Molar Refractivity: 75.17 cm3; (12)Molar Volume: 218.8 cm3; (13)Surface Tension: 47.1 dyne/cm; (14)Density: 1.394 g/cm3; (15)Flash Point: 193 °C; (16)Enthalpy of Vaporization: 64.57 kJ/mol; (17)Boiling Point: 395.5 °C at 760 mmHg; (18)Vapour Pressure: 1.83E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)CBr
(2)InChI: InChI=1S/C15H13BrO2/c16-10-15(17)13-7-4-8-14(9-13)18-11-12-5-2-1-3-6-12/h1-9H,10-11H2
(3)InChIKey: GFZOJLIHCWKKPR-UHFFFAOYSA-N