6-Chloroquinoline

Basic Information

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CAS Number

612-57-7

Molecular Formula

C9H6ClN

Molecular Weight

163.61 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

41-43 °C

Boiling Point

126-127 °C/10 mmHg

Density

1.2108 (rough estimate)

Water Solubility

Insoluble in water.

Refractive Index

1.6110 (estimate)

SMILES

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C1=CC2=C(C=CC(=C2)Cl)N=C1

InChI

InChI=1S/C9H6ClN/c10-8-3-4-9-7(6-8)2-1-5-11-9/h1-6H

InChIKey

GKJSZXGYFJBYRQ-UHFFFAOYSA-N

LogP

2.8882000000000003

Topological Polar Surface Area

12.89 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

138

Safety Information

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Hazard Statement

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

Sensitiveness

Sensitive to air

Synonyms & References

English

CCRIS 3981
InChI=1/C9H6ClN/c10-8-3-4-9-7(6-8)2-1-5-11-9/h1-6
DTXSID3060611
NSC-4682
612-57-7
BCP20124
EN300-42121
PS-5085
J-518663
6-Chloroquinoline
Quinoline, 6-chloro-
AKOS000276639
CHLOROQUINOLINE, 6-
NSC4682
Z425469218
NSC 4682
SB67451
MFCD00024024
EINECS 210-314-1
Quinoline, 6-chloro-,
AMY2634
A833128
AC-5982
SCHEMBL359841
6-chloro-quinoline
FT-0602532
K4A4BAU5SE
UNII-K4A4BAU5SE
6-Chloroquinoline, 99%
NS00034622
Q27281945

MDL Number

MFCD00024024

Customs Code

2933499090

FAQ

What is 6-Chloroquinoline (CAS: 612-57-7)?

6-Chloroquinoline (CAS: 612-57-7) is an organic compound with the chemical formula C9H6ClN. It is a yellow or orange solid with a characteristic odor. It is soluble in organic solvents such as ethanol and acetone.

What are the main uses of 6-Chloroquinoline (CAS: 612-57-7)?

6-Chloroquinoline (CAS: 612-57-7) is primarily used as an intermediate in the synthesis of other organic compounds, particularly in the pharmaceutical and dye industries. It is also used as a reagent in analytical chemistry for the determination of certain metal ions.

Is 6-Chloroquinoline (CAS: 612-57-7) safe?

6-Chloroquinoline (CAS: 612-57-7) is moderately toxic and should be handled with caution. It is important to wear protective gloves and goggles when handling this compound. It should not be ingested or inhaled.

How should 6-Chloroquinoline (CAS: 612-57-7) be stored?

6-Chloroquinoline (CAS: 612-57-7) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. Avoid exposure to temperatures above 30°C to maintain stability.