1-(3-Bromo-4-hydroxyphenyl)ethanone

Name: 1-(3-Bromo-4-hydroxyphenyl)ethanone
Brand: ChemScene
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CAS No. 1836-06-2
Cat. No. CS-0042105
Purity≥96%
MDL No.MFCD03208974

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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1-(3-Bromo-4-hydroxyphenyl)ethanone|CS-0042105

Structure of 1836-06-2

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General Information

CAS No. 1836-06-2
Cat. No. CS-0042105
Purity ≥96%
MDL No. MFCD03208974
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₇BrO₂
Molecular Weight 215.04
Synonym(s) 1-(3-bromo-4-hydroxyphenyl)ethan-1-one
SMILES CC(C1=CC=C(O)C(Br)=C1)=O

Description

This bromohydroxyacetophenone features a para-hydroxylated aromatic ring flanked by a bromine substituent and a ketone-bearing ethyl side chain. The phenolic hydroxyl group enables direct derivatization, while the electron-deficient aryl bromide facilitates palladium-catalyzed cross-coupling reactions under standard conditions. Designed for streamlined synthesis of bioactive intermediates in medicinal chemistry and materials science.

Application

1-(3-Bromo-4-hydroxyphenyl)ethanone serves as a versatile building block in medicinal chemistry and materials science, enabling efficient access to functionalized aryl ketones. The molecule combines a bromo substituent for cross-coupling reactions and a phenolic hydroxyl group for derivatization or protection, offering orthogonal reactivity. Its bench-stable nature and compatibility with standard synthetic protocols facilitate straightforward incorporation into complex molecular architectures.

Synthesis

Route1
- 99-93-4
- ~91%
- In-stock
  
  1836-06-2
References
- Tillu, Vasudha H.; Shinde, Popat D.; Bedekar, Ashutosh V.; Wakharkar, Radhika D. Synthetic Communications, 2003 , vol. 33, # 8 p. 1399 - 1403
Route2
- 95-56-7
- 75-36-5
- ~85%
- In-stock
  
  1836-06-2
References
- Leclerc, Gerard; Bizec, Jean Claude; Bieth, Nicole; Schwartz, Jean Journal of Medicinal Chemistry, 1980 , vol. 23, # 7 p. 738 - 744
Route3
- 99-93-4
- ~20%
- In-stock
  
  1836-06-2
- In-stock
  
  2887-72-1
References
- Heravi, Majid M.; Abdolhosseini, Nafiseh; Oskooie, Hossein A. Tetrahedron Letters, 2005 , vol. 46, # 51 p. 8959 - 8963

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

TPSA 37.3
LogP 2.3573
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Ketone

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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1-(3-Bromo-4-hydroxyphenyl)ethanone

CAS No. 1836-06-2

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