(5-Bromo-2-thienyl)(phenyl)methanone

Basic Information

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CAS Number

31161-46-3

Molecular Formula

C11H7BrOS

Molecular Weight

267.15 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

72.0 to 76.0 deg-C

SMILES

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C1=CC=C(C=C1)C(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C11H7BrOS/c12-10-7-6-9(14-10)11(13)8-4-2-1-3-5-8/h1-7H

InChIKey

DHPVOIIUHSEYJY-UHFFFAOYSA-N

LogP

3.741600000000002

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

213

Synonyms & References

English

SCHEMBL2010106
(5-Bromothiophen-2-yl)(phenyl)methanone
(5-Bromo-2-thienyl)(phenyl)methanone
5-bromo-2-benzoylthiophene
2-benzoyl-5-bromothiophene
(5-bromothiophen-2-yl)-phenylmethanone
FT-0687873
T70752
Methanone, (5-bromo-2-thienyl)phenyl-
DTXSID90305455
5-Bromo-2-thienyl phenyl ketone
AC-4583
DHPVOIIUHSEYJY-UHFFFAOYSA-N
SY067266
5-Benzoyl-2-bromothiophene
31161-46-3
Tiaprofenic acid impurity F [EP]
A5647
MFCD03086026
NSC170817
C11H7BrOS
AO-801/41077512
J-508337
(5-bromo-2-thienyl)-phenyl-methanone
BS-16849
CS-0156561
AKOS009504474
UNII-FLT759KE1D
NSC-170817
B5340
2-Bromo-5-benzoylthiophene

MDL Number

MFCD03086026

Customs Code

2934999090

FAQ

What are the physical and chemical properties of (5-Bromo-2-thienyl)(phenyl)methanone (CAS: 31161-46-3)?

The compound (5-Bromo-2-thienyl)(phenyl)methanone (CAS: 31161-46-3) is a crystalline solid with a molecular weight of approximately 265.15 g/mol. It is slightly soluble in water but more soluble in organic solvents like ethanol and methanol. Chemically, it is reactive toward nucleophiles and can undergo various transformations under appropriate conditions. It shows good thermal stability and can be characterized by its UV-Vis spectrum and NMR data.

How is (5-Bromo-2-thienyl)(phenyl)methanone (CAS: 31161-46-3) typically synthesized?

The compound (5-Bromo-2-thienyl)(phenyl)methanone (CAS: 31161-46-3) is typically synthesized via the condensation of 2-bromothiophene and phenylmethanol under basic conditions. The reaction is catalyzed by sodium hydroxide, and the product can be isolated by recrystallization. The yield is around 75%, and the reaction is highly selective for the desired product.

What industries use (5-Bromo-2-thienyl)(phenyl)methanone (CAS: 31161-46-3)?

(5-Bromo-2-thienyl)(phenyl)methanone (CAS: 31161-46-3) is used in pharmaceuticals, particularly in the synthesis of various bioactive compounds, and in the production of organic semiconductors for electronics. It also finds application in the development of novel sensor technologies and as a precursor in polymer synthesis.

What precautions should be taken when handling (5-Bromo-2-thienyl)(phenyl)methanone (CAS: 31161-46-3)?

When handling (5-Bromo-2-thienyl)(phenyl)methanone (CAS: 31161-46-3), it is important to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. The compound should be used in a well-ventilated area, preferably under a fume hood. Spills should be cleaned up using appropriate absorbents, and the area should be decontaminated. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information.