N-Methyl-3-(1-naphthyloxy)-3-(2-thienyl)-1-propanamine hydrochloride (1:1) | CAS No. 116817-11-9

N-Methyl-3-(1-naphthyloxy)-3-(2-thienyl)-1-propanamine hydrochloride (1:1)

Basic Information

CAS Number

116817-11-9

Molecular Formula

C18H20ClNOS

Molecular Weight

311.45 g/mol

AD

Basic Physical Properties

Melting Point

137-139°C

Boiling Point

466.2°C at 760 mmHg

CNCCC(C1=CC=CS1)OC2=CC=CC3=CC=CC=C32.Cl

InChI

InChI=1S/C18H19NOS.ClH/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16;/h2-10,13,17,19H,11-12H2,1H3;1H

InChIKey

BFFSMCNJSOPUAY-UHFFFAOYSA-N

LogP

4.973100000000004

Topological Polar Surface Area

12.47 Ų

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

312

Safety Information

View Safety Information

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

  • N-methyl-3-(1-naphthyloxy)-3-(2-thienyl)propan-1-amine hydrochloride
  • R-DULOXETINE HYDROCHLORIDE
  • AKOS015961640
  • 116817-11-9
  • N-methyl-3-(naphthalen-1-yloxy)-3-(2-thienyl)propan-1-amine hydrochloride
  • N-methyl-3-(naphthalen-1-yloxy)-3-(thiophen-2-yl)propan-1-amine hydrochloride
  • ( inverted exclamation markA)-Duloxetine (hydrochloride)
  • AS-15954
  • HY-B0161E
  • A803677
  • N-methyl-3-naphthalen-1-yloxy-3-thiophen-2-ylpropan-1-amine;hydrochloride
  • N-methyl-3-naphthalen-1-yloxy-3-thiophen-2-yl-propan-1-amine hydrochloride
  • AC-8272
  • rac-Duloxetine Hydrochloride (1:1 R:S Mixtures)
  • AB23771
  • F0001-2382
  • N-Methyl-3-[(naphthalen-1-yl)oxy]-3-(thiophen-2-yl)propan-1-amine--hydrogen chloride (1/1)
  • FT-0655005
  • MFCD06407958
  • (S)-N-Methyl-3-[(1-naphthyl)oxy]-3-(2-thienyl)-1-propanamine Hydrochloride
  • A807077
  • N-methyl-3-(1-naphthalenyloxy)-3-thiophen-2-yl-1-propanamine hydrochloride
  • SY030752
  • BCP21597
  • 947316-47-4
  • N-methyl-gAmma-(1-naphthalenyloxy)-2-thiophenepropanamine, hydrochloride
  • (+)-(S)-n-methyl-g-(1-naphthyloxy)-2-thiophenepropylamine, hydrochloride/duloxetinehcl
  • FT-0667811
  • CHEBI:36808
  • FT-0648818
  • Duloxetine EP impurity A

MDL Number

MFCD09750960

Customs Code

2934999090

FAQ

What are the physical and chemical properties of N-Methyl-3-(1-naphthyloxy)-3-(2-thienyl)-1-propanamine hydrochloride (CAS: 116817-11-9)?

N-Methyl-3-(1-naphthyloxy)-3-(2-thienyl)-1-propanamine hydrochloride is a crystalline compound with a molecular weight of approximately 391.34 g/mol. It has a high solubility in water and moderate solubility in organic solvents. The compound is reactive towards nucleophiles and can undergo substitution reactions. It also displays basic properties due to the presence of the amino group and the hydrochloride salt form.

How is N-Methyl-3-(1-naphthyloxy)-3-(2-thienyl)-1-propanamine hydrochloride (CAS: 116811-9) typically synthesized?

N-Methyl-3-(1-naphthyloxy)-3-(2-thienyl)-1-propanamine hydrochloride is typically synthesized via a multi-step process involving the coupling of naphthol and thiophene derivatives, followed by alkylation and amidation reactions. The synthesis involves the use of reagents like sodium hydride and acetic acid. The overall yield is moderate, around 50-60%, and the reaction is carried out under basic conditions.

What industries use N-Methyl-3-(1-naphthyloxy)-3-(2-thienyl)-1-propanamine hydrochloride (CAS: 116817-11-9)?

N-Methyl-3-(1-naphthyloxy)-3-(2-thienyl)-1-propanamine hydrochloride is used in pharmaceuticals for its potential as an intermediate in the synthesis of various drugs. It may also have applications in the development of sensors and semiconductors due to its electronic properties. Additionally, it might be used in polymer chemistry for specific functionalization purposes.

What precautions should be taken when handling N-Methyl-3-(1-naphthyloxy)-3-(2-thienyl)-1-propanamine hydrochloride (CAS: 116817-11-9)?

When handling N-Methyl-3-(1-naphthyloxy)-3-(2-thienyl)-1-propanamine hydrochloride, it is essential to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. The compound should be stored in a cool, dry place away from direct sunlight and heat sources. In case of a spill, it should be handled under a fume hood, and the Safety Data Sheet (SDS) should be consulted for specific spill cleanup procedures.

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