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5,5-Dimethyl-2-propyl-3-thiomorpholinone

Names

[ CAS No. ]:
69226-14-8

[ Name ]:
5,5-Dimethyl-2-propyl-3-thiomorpholinone

[Synonym ]:
3-Oxo-5.5-dimethyl-2-propyl-thiomorpholin
5,5-dimethyl-2-propyl-thiomorpholin-3-one
3-Thiomorpholinone,5,5-dimethyl-2-propyl
5,5-Dimethyl-2-propyl-3-thiomorpholinone

Chemical & Physical Properties

[ Density]:
0.98g/cm3

[ Boiling Point ]:
334.2ºC at 760 mmHg

[ Molecular Formula ]:
C9H17NOS

[ Molecular Weight ]:
187.30200

[ Flash Point ]:
155.9ºC

[ Exact Mass ]:
187.10300

[ PSA ]:
54.40000

[ LogP ]:
2.12550

[ Index of Refraction ]:
1.47

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XM3072000
CHEMICAL NAME :
3-Thiomorpholinone, 5,5-dimethyl-2-propyl-
CAS REGISTRY NUMBER :
69226-14-8
BEILSTEIN REFERENCE NO. :
0123204
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H17-N-O-S
MOLECULAR WEIGHT :
187.33
WISWESSER LINE NOTATION :
T6MV DSTJ C3 F1 F1

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 :
3 gm/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

Precursor & DownStream


Related Compounds