2-((1-Methyl-2-(phenylthio)ethyl)amino)ethanol

Modify Date: 2025-08-30 09:39:31

2-((1-Methyl-2-(phenylthio)ethyl)amino)ethanol Structure
2-((1-Methyl-2-(phenylthio)ethyl)amino)ethanol structure
Common Name 2-((1-Methyl-2-(phenylthio)ethyl)amino)ethanol
CAS Number 5877-16-7 Molecular Weight 211.32400
Density N/A Boiling Point N/A
Molecular Formula C11H17NOS Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-(1-phenylsulfanylpropan-2-ylamino)ethanol
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C11H17NOS
Molecular Weight 211.32400
Exact Mass 211.10300
PSA 57.56000
LogP 2.14000
InChIKey ANSUFFQBQSMRFA-UHFFFAOYSA-N
SMILES CC(CSc1ccccc1)NCCO

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KL8100000
CHEMICAL NAME :
Ethanol, 2-((1-methyl-2-(phenylthio)ethyl)amino)-
CAS REGISTRY NUMBER :
5877-16-7
BEILSTEIN REFERENCE NO. :
3050471
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H17-N-O-S
MOLECULAR WEIGHT :
211.35
WISWESSER LINE NOTATION :
Q2MY1&1SR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#01234

 Synthetic Route

~%

2-((1-Methyl-2-(phenylthio)ethyl)amino)ethanol Structure

2-((1-Methyl-2-...

CAS#:5877-16-7

Literature: Lamdan; Vega; Gaozza Journal of medicinal chemistry, 1966 , vol. 9, # 1 p. 79 - 83

~%

2-((1-Methyl-2-(phenylthio)ethyl)amino)ethanol Structure

2-((1-Methyl-2-...

CAS#:5877-16-7

Literature: Lamdan; Vega; Gaozza Journal of medicinal chemistry, 1966 , vol. 9, # 1 p. 79 - 83 Title/Abstract Full Text View citing articles Show Details Smith, Kline and French Labor. Patent: US2774770 , 1951 ;

 Synonyms

2-((1-Methyl-2-(phenylthio)ethyl)amino)ethanol
Ethanol,2-[[1-methyl-2-(phenylthio)ethyl]amino]
Diethylamine,2'-hydroxy-1-methyl-2-phenylthio
N-(Phenylmercaptoisopropyl)-2-hydroxy-aethylamin
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