1-[8-(Benzyloxy)-2-hydroxy-5-quinolinyl]-2-bromoethanone

Basic Information

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CAS Number

100331-89-3

Molecular Formula

C18H14BrNO3

Molecular Weight

372.22 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 Ethers

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

Physical State

Pale-yellow to Yellow-brown Solid

Boiling Point

602.6℃ at 760 mmHg

SMILES

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C1=CC=C(C=C1)COC2=C3C(=C(C=C2)C(=O)CBr)C=CC(=O)N3

InChI

InChI=1S/C18H14BrNO3/c19-10-15(21)13-6-8-16(18-14(13)7-9-17(22)20-18)23-11-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,20,22)

InChIKey

RVHSDLUBNZBRMH-UHFFFAOYSA-N

LogP

3.684700000000002

Topological Polar Surface Area

59.16 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

473

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Synonyms & References

English

RVHSDLUBNZBRMH-UHFFFAOYSA-N
AC-24608
J-000105
AKOS025214116
8-(Benzyloxy)-5-(2-bromoacetyl)quinolin-2(1H)-one
8-Benzyloxy-5-bromoacetylcarbostyril
SCHEMBL99439
8-(Benzyloxy)-5-(bromoacetyl)quinolin-2(1H)-one
100331-89-3
5-Bromoacetyl-8-benzyloxycarbostyril
8-benzyloxy-5-(2-bromo-acetyl)-1h-quinolin-2-one
BCP22356
DTXSID50470330
SY045270
MFCD09025318
2(1H)-Quinolinone, 5-(bromoacetyl)-8-(phenylmethoxy)-
A16169
5-(2-bromoacetyl)-8-phenylmethoxy-1H-quinolin-2-one
AKOS015920361
8-Benzyloxy-5-(2-bromoacetyl)-2(1H)-quinolinone
FT-0630054
SB73046
1-(8-(benzyloxy)-2-hydroxyquinolin-5-yl)-2-bromoethanone
8-Benzyloxy-5-(2-Bromoacetyl)-1H-quinolin-2-one
J-519371
8-Benzyloxy 5-(2-bromoacetyl)-1H-quinolin-2-one
8-benzyloxy-5-(2-bromoacetyl)quinolin-2(1h)-one
CS-0100873
1-[8-(benzyloxy)-2-hydroxyquinolin-5-yl]-2-bromoethan-1-one
8-Benzyloxy-5-(2-bromoacetyl)-2-hydroxyquinoline
1-(8-(Benzyloxy)-2-hydroxyquinolin-5-yl)-2-bromoethanone

MDL Number

MFCD09025318

Customs Code

2942000000

FAQ

What is 1-[8-(Benzyloxy)-2-hydroxy-5-quinolinyl]-2-bromoethanone (CAS: 100331-89-3)?

1-[8-(Benzyloxy)-2-hydroxy-5-quinolinyl]-2-bromoethanone is a synthetic organic compound. Its chemical formula is C20H16BrNO4. This compound is characterized by its brominated quinoline ring and hydroxy groups, which give it unique reactivity in organic synthesis.

What are the main uses of 1-[8-(Benzyloxy)-2-hydroxy-5-quinolinyl]-2-bromoethanone (CAS: 100331-89-3)?

1-[8-(Benzyloxy)-2-hydroxy-5-quinolinyl]-2-bromoethanone is primarily used in the pharmaceutical industry for its potential in organic synthesis and as a precursor for the development of new drugs. It is also utilized in research applications for studying the properties of quinoline derivatives.

Is 1-[8-(Benzyloxy)-2-hydroxy-5-quinolinyl]-2-bromoethanone (CAS: 100331-89-3) safe?

1-[8-(Benzyloxy)-2-hydroxy-5-quinolinyl]-2-bromoethanone is not considered inherently hazardous but should be handled with caution due to its bromine content. It is important to follow safety guidelines, wear appropriate personal protective equipment, and ensure proper ventilation during handling. Storage and disposal should comply with local regulations and safety standards.

How should 1-[8-(Benzyloxy)-2-hydroxy-5-quinolinyl]-2-bromoethanone (CAS: 100331-89-3) be stored?

1-[8-(Benzyloxy)-2-hydroxy-5-quinolinyl]-2-bromoethanone should be stored in a cool, dry place away from direct sunlight and heat sources. Keep the compound in a tightly closed container to prevent exposure to air and moisture. It is advisable to store it at room temperature or slightly below, and avoid storing it in humid environments to maintain its stability.