5-ethyl-2,2-dimethylthiomorpholin-3-one

Modify Date: 2024-02-06 10:09:31

5-ethyl-2,2-dimethylthiomorpholin-3-one Structure
5-ethyl-2,2-dimethylthiomorpholin-3-one structure
Common Name 5-ethyl-2,2-dimethylthiomorpholin-3-one
CAS Number 69226-12-6 Molecular Weight 173.27600
Density 0.993g/cm3 Boiling Point 321.4ºC at 760 mmHg
Molecular Formula C8H15NOS Melting Point N/A
MSDS N/A Flash Point 148.2ºC

 Names

Name 5-ethyl-2,2-dimethylthiomorpholin-3-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.993g/cm3
Boiling Point 321.4ºC at 760 mmHg
Molecular Formula C8H15NOS
Molecular Weight 173.27600
Flash Point 148.2ºC
Exact Mass 173.08700
PSA 54.40000
LogP 1.73540
Index of Refraction 1.47

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XM3068000
CHEMICAL NAME :
3-Thiomorpholinone, 2,2-dimethyl-5-ethyl-
CAS REGISTRY NUMBER :
69226-12-6
BEILSTEIN REFERENCE NO. :
0119922
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H15-N-O-S
MOLECULAR WEIGHT :
173.30
WISWESSER LINE NOTATION :
T6MV DSTJ C1 C1 F2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
593 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 6,136,1963

 Synthetic Route

~%

5-ethyl-2,2-dimethylthiomorpholin-3-one Structure

5-ethyl-2,2-dim...

CAS#:69226-12-6

Literature: Hoffmann-La Roche Patent: US2755278 , 1954 ;

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

5-Aethyl-2,2-dimethyl-thiomorpholin-3-on
5-ethyl-2,2-dimethyl-thiomorpholin-3-one
3-Oxo-2.2-dimethyl-5-aethyl-thiomorpholin
2,2-Dimethyl-5-ethyl-3-thiomorpholinone
3-Thiomorpholinone,2,2-dimethyl-5-ethyl