5-Chloro-1,2,3,4-tetrahydro-1,6-naphthyridine

Basic Information

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CAS Number

98490-61-0

Molecular Formula

C8H9ClN2

Molecular Weight

168.63 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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C1CC2=C(C=CN=C2Cl)NC1

InChI

InChI=1S/C8H9ClN2/c9-8-6-2-1-4-10-7(6)3-5-11-8/h3,5,10H,1-2,4H2

InChIKey

JVMIUCCIXSCUTR-UHFFFAOYSA-N

LogP

2.0930999999999997

Topological Polar Surface Area

24.92 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

140

Synonyms & References

English

FT-0646786
5-chloranyl-1,2,3,4-tetrahydro-1,6-naphthyridine
SY258334
AKOS006323052
CS-0095820
A845865
J-517233
SCHEMBL20112728
AB64180
AS-38626
DTXSID20672026
98490-61-0
MFCD11518945
5-CHLORO-1,2,3,4-TETRAHYDRO-1,6-NAPHTHYRIDINE
5-Chloro-1,2,3,4-tetrahydro-1,6-naphthyridine
1,6-Naphthyridine,5-chloro-1,2,3,4-tetrahydro-
5-chloro-1,2,3,4-tetrahydro-1,6-naphthyridine

MDL Number

MFCD11518945

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 5-Chloro-1,2,3,4-tetrahydro-1,6-naphthyridine (CAS: 98490-61-0)?

5-Chloro-1,2,3,4-tetrahydro-1,6-naphthyridine (CAS: 98490-61-0) is a solid crystalline compound with a molecular weight of approximately 207.66 g/mol. It has a melting point of 157-159°C and is slightly soluble in water. This compound shows limited reactivity in aqueous solutions but can undergo substitution reactions under certain conditions.

How is 5-Chloro-1,2,3,4-tetrahydro-1,6-naphthyridine (CAS: 98490-61-0) typically synthesized?

5-Chloro-1,2,3,4-tetrahydro-1,6-naphthyridine (CAS: 98490-61-0) can be synthesized via a multi-step process involving the reaction of 1,2,3,4-tetrahydro-1,6-naphthyridine with chlorine gas in the presence of a suitable catalyst. The reaction is typically conducted at elevated temperatures to ensure high yield and selectivity.

What industries use 5-Chloro-1,2,3,4-tetrahydro-1,6-naphthyridine (CAS: 98490-61-0)?

5-Chloro-1,2,3,4-tetrahydro-1,6-naphthyridine (CAS: 98490-61-0) is primarily used in the pharmaceutical industry for the synthesis of various medicinal compounds. It also finds applications in the polymer industry for modifying polymer properties and in the sensor and semiconductor sectors for electronic applications.

What precautions should be taken when handling 5-Chloro-1,2,3,4-tetrahydro-1,6-naphthyridine (CAS: 98490-61-0)?

Precautions when handling 5-Chloro-1,2,3,4-tetrahydro-1,6-naphthyridine (CAS: 98490-61-0) include wearing appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or fume hood to minimize inhalation risks. Spills should be cleaned up using appropriate absorbents and disposed of according to local regulations. Always refer to the safety data sheet (SDS) for detailed handling instructions.