3-Thiomorpholinone, 2,2,5-trimethyl-

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Names

[ CAS No. ]:
69226-24-0

[ Name ]:
3-Thiomorpholinone, 2,2,5-trimethyl-

[Synonym ]:
3-Oxo-2.5.5-trimethyl-thiomorpholin
3-Thiomorpholinone,2,2,5-trimethyl
3-Thiomorpholinone,2,5-trimethyl
2,2,5-trimethyl-thiomorpholin-3-one
2,2,5-Trimethyl-3-thiomorpholinone

Chemical & Physical Properties

[ Density]:
1.015g/cm3

[ Boiling Point ]:
309ºC at 760 mmHg

[ Molecular Formula ]:
C7H13NOS

[ Molecular Weight ]:
159.24900

[ Flash Point ]:
140.7ºC

[ Exact Mass ]:
159.07200

[ PSA ]:
54.40000

[ LogP ]:
1.34530

[ Index of Refraction ]:
1.474

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XM3092000
CHEMICAL NAME :
3-Thiomorpholinone, 2,2,5-trimethyl-
CAS REGISTRY NUMBER :
69226-24-0
BEILSTEIN REFERENCE NO. :
0113727
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H13-N-O-S
MOLECULAR WEIGHT :
159.27
WISWESSER LINE NOTATION :
T6MV DSTJ C1 C1 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 :
3458 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

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-MERCAPTO-2-METHYL-PROPANOIC ACID ETHYL ESTER
  • 2-Methylaziridine

DownStream

Related Compounds

  • 3-Thiomorpholinone,2,2,5,5-tetramethyl-
  • 2,2,5-Trimethyl-3-thiomorpholinone
  • Benzeneacetic acid, .α.-acetyl-2-nitro-, ethyl ester (en)
  • 2,2,5-TRIETHYLTHIOMORPHOLIN-3-ONE
  • fruity cyclopentanone
  • 3-Thiomorpholinone, 2,5,5-trimethyl-
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • 2-chloro-4-fluoro-N-{2-[4-(furan-2-yl)-1-methyl-1H-imidazol-2-yl]ethyl}benzamide
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide