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197610

2-(3-Bromophenyl)-1,3-dioxolane

Name: 2-(3-Bromophenyl)-1,3-dioxolane
Brand: ALDRICH

95%

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About This Item

Empirical Formula (Hill Notation):

C₉H₉BrO₂

CAS Number:

17789-14-9

Molecular Weight:

229.07

NACRES:

NA.22

PubChem Substance ID:

24851838

UNSPSC Code:

12352100

EC Number:

241-766-8

MDL number:

MFCD00003209

Assay:

95%

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Properties

assay

95%

refractive index

n20/D 1.563 (lit.)

bp

132-133 °C/8 mmHg (lit.)

density

1.514 g/mL at 25 °C (lit.)

functional group

bromo, ether

SMILES string

Brc1cccc(c1)C2OCCO2

InChI

1S/C9H9BrO2/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-3,6,9H,4-5H2

InChI key

VYPYKCPWNPPBBX-UHFFFAOYSA-N

Description

Application

2-(3-Bromophenyl)-1,3-dioxolane was used in the synthesis of acetal by arylation of 1-benzylpiperidin-4-amine.

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves

Regulatory Information

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Delta agonist hydroxy bioisosteres: the discovery of 3-((1-benzylpiperidin-4-yl){4-[(diethylamino)carbonyl]phenyl}amino)benzamide with improved delta agonist activity and in vitro metabolic stability.

Andrew M Griffin et al.

Bioorganic & medicinal chemistry letters, 19(21), 5999-6003 (2009-10-06)

We have investigated phenol replacements in a series of diaryl amino piperidine delta opioid agonists. From this study we have demonstrated that the hydroxy functional group can be replaced with a primary amide group, giving enhanced activity at the delta

Global Trade Item Number

SKU	GTIN
197610-25G	04061837006647