7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride (1:1)

Basic Information

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CAS Number

73075-45-3

Molecular Formula

C9H11Cl2N

Molecular Weight

204.1 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

SMILES

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C1CNCC2=C1C=CC(=C2)Cl.Cl

InChI

InChI=1S/C9H10ClN.ClH/c10-9-2-1-7-3-4-11-6-8(7)5-9;/h1-2,5,11H,3-4,6H2;1H

InChIKey

OGIAIXMUSSACDB-UHFFFAOYSA-N

LogP

2.407500000000001

Topological Polar Surface Area

12.03 Å²

Hydrogen Bond Donor/Acceptor

1 / 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

Synonyms & References

English

73075-45-3
EN300-111670
7-CHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE HYDROCHLORIDE
Z1716481593
J-519183
CS-0036914
F9995-1264
SCHEMBL1124954
7-Chloro-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1)
7-CHLORO-1,2,3,4-TETRAHYDROISOQUINOLINEHYDROCHLORIDE
DTXSID20503765
J-518486
7-Chloro-1,2,3,4-tetrahydroisoquinoline;hydrochloride
DS-12090
MFCD08461076
AKOS015958730
O11644
Isoquinoline, 7-chloro-1,2,3,4-tetrahydro-, hydrochloride
A914146
7-Chloro-1,2,3,4-Tetrahydroisoquinoline HCl
FT-0698904
SY115701
7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride

MDL Number

MFCD08461076

Customs Code

2933499090

FAQ

What are the physical and chemical properties of 7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride (CAS: 73075-45-3)?

7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride is a white crystalline solid with a molecular weight of approximately 243.58 g/mol. It has good water solubility and is poorly soluble in organic solvents like ethanol and acetone. This compound is less reactive but can undergo nucleophilic substitution reactions under certain conditions. It is stable under normal laboratory conditions but should be stored in a cool, dry place and protected from moisture.

How is 7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride (CAS: 73075-45-3) typically synthesized?

7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride is typically synthesized via the chlorination of 1,2,3,4-tetrahydroisoquinoline followed by protonation with hydrochloric acid. The reaction is usually carried out under mild conditions, and the yield is around 70-80%. The use of a catalyst such as a Lewis acid can improve selectivity and yield.

What industries use 7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride (CAS: 73075-45-3)?

7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride is primarily used in pharmaceuticals and research. It serves as a precursor in the synthesis of various bioactive compounds and is also utilized in the development of new drug candidates. Additionally, it finds applications in the chemical industry for its potential use in developing sensors and other analytical tools.

What precautions should be taken when handling 7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride (CAS: 73075-45-3)?

When handling 7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride, it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and lab coat. The substance should be handled in a well-ventilated area or fume hood to minimize inhalation risks. In case of a spill, it should be cleaned up immediately using absorbent materials and proper disposal procedures should be followed. Always refer to the Safety Data Sheet (SDS) for specific handling and disposal instructions.