1,5-Dichloroisoquinoline

Basic Information

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CAS Number

70810-23-0

Molecular Formula

C9H5Cl2N

Molecular Weight

198.05 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

147 ºC

Boiling Point

327.7℃ at 760 mmHg

Density

1.407±0.06 g/cm3 (20 ºC 760 Torr),

SMILES

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C1=CC2=C(C=CN=C2Cl)C(=C1)Cl

InChI

InChI=1S/C9H5Cl2N/c10-8-3-1-2-7-6(8)4-5-12-9(7)11/h1-5H

InChIKey

IKLNCVLTIQMRDB-UHFFFAOYSA-N

LogP

3.5416000000000007

Topological Polar Surface Area

12.89 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

163

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

Synonyms & References

English

isoquinoline, 1,5-dichloro-
CS-0042577
F8885-1719
EN300-397895
DTXSID00305466
1,5-dichloroisoquinoline
70810-23-0
AKOS016004224
DS-3755
InChI=1/C9H5Cl2N/c10-8-3-1-2-7-6(8)4-5-12-9(7)11/h1-5
FT-0749220
AB64606
NSC-170841
AM85385
MFCD11846292
VCA81023
SCHEMBL1315786
NSC170841
1,5-Dichloroisoquinoline
1,5-Dichlorisochinolin
1,5-Dichlor-isochinolin
1,5-dichloro-isoquinoline
AC1L6TE9
ACT10191
ANW-62621
CTK8B9503
0983AC
AK101842
AB0057196
ST2408489

MDL Number

MFCD11846292

FAQ

What is 1,5-Dichloroisoquinoline (CAS: 70810-23-0)?

1,5-Dichloroisoquinoline is a chemical compound with the CAS number 70810-23-0. It has the chemical formula C9H5Cl2N. This compound is characterized by its yellow crystalline form and is used in various applications including medicinal chemistry and research.

What are the main uses of 1,5-Dichloroisoquinoline (CAS: 70810-23-0)?

1,5-Dichloroisoquinoline is mainly used in the pharmaceutical industry as a precursor for the synthesis of various organic compounds. It is also utilized in academic research for studying the properties and reactions of aromatic compounds.

Is 1,5-Dichloroisoquinoline (CAS: 70810-23-0) safe?

1,5-Dichloroisoquinoline is a hazardous chemical and should be handled with caution. It is classified as a skin and eye irritant and requires proper personal protective equipment (PPE) such as gloves and goggles. Storage and handling should be done in a well-ventilated area, away from direct sunlight and heat sources.

How should 1,5-Dichloroisoquinoline (CAS: 70810-23-0) be stored?

1,5-Dichloroisoquinoline should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed, glass container to prevent exposure to moisture and light. Proper ventilation is essential during storage to avoid the formation of potentially explosive vapors.