1-methylsulfonylsulfanylhexadecane

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Names

[ CAS No. ]:
7559-47-9

[ Name ]:
1-methylsulfonylsulfanylhexadecane

[Synonym ]:
Methanethiosulfonic acid S-hexadecyl ester
Methanesulfonothioic Acid S-Hexadecyl Ester
n-Hexadecyl-methylthiolsulfonat
Thio-Methanesulfonic Acid S-Hexadecyl Ester

Chemical & Physical Properties

[ Density]:
0.978g/cm3

[ Boiling Point ]:
458.4ºC at 760 mmHg

[ Melting Point ]:
61-63ºC

[ Molecular Formula ]:
C17H36O2S2

[ Molecular Weight ]:
336.59700

[ Flash Point ]:
231ºC

[ Exact Mass ]:
336.21600

[ PSA ]:
67.82000

[ LogP ]:
7.24130

[ Index of Refraction ]:
1.479

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
PB2750000
CHEMICAL NAME :
Methanesulfonic acid, thio-, S-hexadecyl ester
CAS REGISTRY NUMBER :
7559-47-9
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H36-O2-S2

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 :
100 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#04604

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Sodium methanesulfinate
  • 1-Bromohexadecane
  • Potassium thiomethanesulfonate

DownStream

Related Compounds

  • 1-phenyl-3H-[1,2,4]triazolo[4,3-a]quinazolin-5-one
  • 1-[2-(2-fluorobenzoyl)pyrrol-1-yl]propan-2-yl-dimethylazanium,chloride
  • 1-[4-Amino-3-chloro-5-(trifluoromethyl)phenyl]-2-bromo-ethanone
  • 1,4-BenzenediaMine, N,N,N',N'-tetrakis[4-[bis(2-Methylpropyl)aMino]phenyl]-
  • 1-[2-(2-methoxybenzoyl)pyrrol-1-yl]propan-2-yl-dimethylazanium,chloride
  • 1-(4-Amino-3,5-dichloro-phenyl)-2-tert-butylamino-ethanone Hydrochloride
  • 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)-
  • (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
  • N-methyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]cyclopropanesulfonamide
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide