(1R,4S)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride (1:1) | CAS No. 79617-99-5

(1R,4S)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride (1:1)

Basic Information

CAS Number

79617-99-5

Molecular Formula

C17H18Cl3N

Molecular Weight

342.7 g/mol

AD

Basic Physical Properties

Melting Point

275-277°C

Boiling Point

443.8 °C at 760 mmHg

Flash Point

222.2 °C

CN[C@@H]1CC[C@H](c2c1cccc2)c3ccc(c(c3)Cl)Cl.Cl

InChI

InChI=1S/C17H17Cl2N.ClH/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11;/h2-6,8,10,12,17,20H,7,9H2,1H3;1H/t12-,17+;/m0./s1

InChIKey

BLFQGGGGFNSJKA-LWHGMNCYSA-N

LogP

5.6014000000000035

Topological Polar Surface Area

12.03 Ų

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

322

Synonyms & References

English

  • Sertraline basis
  • Seraline
  • 4-(3,4-Dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenimine hydrochloride
  • 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-N-Methyl-1-naphthalenaminehydrochlroide
  • SERTRALINE RACEMATE HCl
  • (+)-cis-N-Methyl-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-1-naphthalenamine hyd
  • Sertraline hydrechloride
  • 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-1-NAPHTHALENAMINE HCL
  • 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-1-NAPHTHALENAMINEHYDROCHLORIDE
  • cis-N-Methyl-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride
  • 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-1-NAPTHALENAMINE
  • 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-1-NAPHTHALENIMINECHLORIDE
  • RACEMIC SERTRALINE HYDROCHLORIDE
  • CIS-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-n-methyl-1-naphthalenamine hcl
  • Sertraline Racemate
  • intermediate of sertraline
  • sertraline intermediate
  • 4-(3,4-dichlorophenyl)-N-methyl-3,4-dihydro-2H-naphthalen-1-imine,hydrochloride
  • (1S*,2S*)-2-phenylcyclohexanol
  • (1S*,4R*)-trans 4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-napthalenamine hydrochloride
  • 2-PHENYL-CYCLOHEXANOL(CIS)
  • cis-2-phenyl-1-cyclohexanol
  • cis-2-phenylcyclohexan-1-ol
  • cis-2-phenyl-cyclohexanol
  • trans-2-phenylcyclohexanol
  • trans-N-methyl-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride
  • 1R,4S)-rel-4-(3,4-Dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine hydrochloride
  • (1R,4S)-rel-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
  • hydrochloride (1:1)

MDL Number

MFCD09025656

FAQ

What are the physical and chemical properties of (1R,4S)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride (CAS: 79617-99-5)?

(1R,4S)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride is a white crystalline solid. Its molecular weight is approximately 336.1 g/mol. It has a solubility of about 1.3 g/L in water and is moderately soluble in common organic solvents. The compound reacts with bases and is stable under normal storage conditions. It is not flammable but can decompose at high temperatures, releasing toxic fumes.

How is (1R,4S)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride (CAS: 79617-99-5) typically synthesized?

(1R,4S)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride is synthesized via a multi-step process involving the coupling of a 3,4-dichloroaniline derivative and a substituted naphthalene, followed by hydrogenation and hydrochloric acid treatment. The process is carried out under mild conditions to ensure high yield and selectivity.

What industries use (1R,4S)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride (CAS: 79617-99-5)?

(1R,4S)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride is used in the pharmaceutical industry for developing certain types of analgesics and anti-inflammatory drugs. It is also utilized in the polymer industry for modifying material properties and in the semiconductor industry for enhanced conductivity and stability.

What precautions should be taken when handling (1R,4S)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride (CAS: 79617-99-5)?

When handling (1R,4S)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydro-1-naphthalenamine hydrochloride, use appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Store in a cool, dry place away from direct sunlight and heat sources. Use in a well-ventilated area or fume hood to avoid inhalation of fumes. In case of spill, neutralize with appropriate absorbent materials and dispose of according to local regulations. Refer to the Safety Data Sheet (SDS) for detailed information.

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