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116539-55-0

(S)-3-Methylamino-1-(2-thienyl)-1-propanol

CAS: 116539-55-0

Molecular Formula: C8H13NOS

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116539-55-0 - Names and Identifiers

Name (S)-3-Methylamino-1-(2-thienyl)-1-propanol
Synonyms N-Meth
(S)-3-Methylamino-1-(2-thienyl)-1-propanol
(S)-3-(Methylamino)-1-(2-thienyl)-1-propanol
(S)-3-Methylamino-1-(thiophene-2-yl)Propan-1-ol
N-Methyl-3-hydroxy-3-(2-thienyl)-3-aMinopropane
(S)-N-methyl-3-hydroxy-3-(2-thienyl)propanamine
(S)-2-[3-(Methylamino)-1-hydroxypropyl]thiophene
(S)-α-[2-(MethylaMino)ethyl]-2-thiopheneMethanol
(S)-3-(Methylamino)-1-(thiophen-2-yl)propan-l-ol
(1S)-3-(methylamino)-1-(thiophen-2-yl)propan-1-ol
(1S)-(-)-3-(MethylaMino)-1-(thien-2-yl)propan-1-ol
(S)-(-)-3-(N-Methylamino)-1-(2-Thienyl)-1-Propanol
2-ThiopheneMethanol, a-[2-(MethylaMino)ethyl]-, (aS)-
3-Methylamino-1-(2-thienyl)-1-propanol,Duloxetine intermediate
CAS 116539-55-0
EINECS 601-437-5
InChI InChI=1/C8H13NOS/c1-9-5-4-7(10)8-3-2-6-11-8/h2-3,6-7,9-10H,4-5H2,1H3
InChIKey YEJVVFOJMOHFRL-ZETCQYMHSA-N

116539-55-0 - Physico-chemical Properties

Molecular FormulaC8H13NOS
Molar Mass171.26
Density1.128±0.06 g/cm3(Predicted)
Melting Point72.0 to 76.0 °C
Boling Point294.3±35.0 °C(Predicted)
Flash Point131.781°C
Solubility Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
Vapor Presure0.001mmHg at 25°C
AppearanceSolid
ColorOff-White to Pink
pKa13.77±0.20(Predicted)
Storage Conditionunder inert gas (nitrogen or Argon) at 2–8 °C
Refractive Index1.553
MDLMFCD07357308
UseDuloxetine intermediate

116539-55-0 - Reference Information

Properties 3-methylamino-1-(2-thienyl)-1-propanol is gray or pink at room temperature and pressure Solid.
Uses 3-methylamino-1-(2-thienyl)-1-propanol is a synthetic intermediate of serotonin (5-HT) and norepinephrine (NE) reuptake inhibitor duloxetine, a selective serotonin (5-HT) and norepinephrine (NE) reuptake inhibitor. The mechanism of duloxetine's antidepressant and central analgesia is not yet clear, but it is believed that it is related to its enhancement of serotonergic and noradrenergic function in the central nervous system.
preparation method add N-methyl-N-isobutoxycarbonyl -3-hydroxy -3-(2-thienyl) propylamine 114.8mg(0.42mmol) and 2-propanol 5ml into a 1L four-necked flask equipped with a dropping funnel, a stirrer, a cooling tube and a thermometer, 0.2g of sodium hydroxide aqueous solution with a volume fraction of 30% was added and allowed to react at 30 degrees for 24 hours. After the reaction is completed, the reaction solution is concentrated, the residue is extracted with ethyl acetate, the combined ethyl acetate layer is dried with anhydrous sodium sulfate, the solvent is dried in vacuum, and the residue is purified by silica gel column chromatography to obtain 3-Methylamino -1-(2-thienyl)-1-propanol with a yield of 92%. Fig. 3-synthesis route of methylamino -1-(2-thienyl)-1-propanol
Last Update:2024-04-09 21:04:16
116539-55-0
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