Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate

Basic Information

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CAS Number

98349-25-8

Molecular Formula

C15H13F2NO3

Molecular Weight

293.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

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

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

229-230 ºC (ethyl acetate )

Boiling Point

419.5°C at 760 mmHg

Density

1.433±0.06 g/cm3 (20 ºC 760 Torr),

Solubility

Insuluble (2.8E-3 g/L) (25 ºC),

SMILES

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CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)F)C3CC3

InChI

InChI=1S/C15H13F2NO3/c1-2-21-15(20)10-7-18(8-3-4-8)13-6-12(17)11(16)5-9(13)14(10)19/h5-8H,2-4H2,1H3

InChIKey

QYGNYHKBMNUIJN-UHFFFAOYSA-N

LogP

2.7913000000000014

Topological Polar Surface Area

48.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

489

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

ethyl 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinoline-carboxylate
QYGNYHKBMNUIJN-UHFFFAOYSA-N
DTXSID50431269
ETHYL 1-CYCLOPROPYL-6,7-DIFLUORO-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLATE
1-cyclopropyl-6,7-difluoro- 1,4-dihydro-4-oxo-3-quinolinecarboxylic acid, ethyl ester
A917075
NS00006889
C15H13F2NO3
CS-0151710
98349-25-8
CL1050
ethyl 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylate
1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid, ethyl ester
DS-11689
SY046721
SB71654
ethyl 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylate
ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate
ETHYL1-CYCLOPROPYL-6,7-DIFLUORO-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLATE
AKOS027325846
EC 422-380-0
MFCD01646378
SCHEMBL4306583
BCP13372
E1181
ethyl 1-cyclopropyl-1,4-dihydro-6,7-difluoro-4-oxo-quinoline-3-carboxylate
ethyl 1-cyclopropyl-6,7-difluoro-4-oxoquinoline-3-carboxylate
3-Quinolinecarboxylic acid,1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-, ethyl ester
Ethyl 1-Cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate
ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
AK320542

MDL Number

MFCD01646378

FAQ

What is Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate (CAS: 98349-25-8)?

Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate is a complex organic compound with the CAS number 98349-25-8. It is a derivative of quinoline and contains a cyclopropyl group, two fluorine atoms, and an ethyl ester group. This compound is characterized by its unique chemical structure, which can be used in various applications depending on its specific properties.

What are the main uses of Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate (CAS: 98349-25-8)?

Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate is primarily used in the pharmaceutical industry for its potential applications in drug synthesis and development. It may also be used in research and development for its unique chemical properties, and in the chemical industry for specialized reactions and synthesis processes.

Is Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate (CAS: 98349-25-8) safe?

Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate is generally considered safe for use in the laboratory and industrial settings with appropriate safety measures in place. It is important to follow all safety guidelines, such as wearing protective clothing and using proper ventilation. However, it is always advisable to consult the Material Safety Data Sheet (MSDS) for detailed safety information.

How should Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate (CAS: 98349-25-8) be stored?

Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate should be stored in a cool, dry place away from direct sunlight and sources of heat. It is recommended to keep it in a tightly sealed container to prevent degradation and contamination. The storage temperature should be maintained between 15°C and 25°C. Humidity levels should be controlled to avoid moisture exposure, which could affect the compound's stability and reactivity.