2-methyl-2-phenyl-1,3-dithiolane

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Names

[ CAS No. ]:
5769-02-8

[ Name ]:
2-methyl-2-phenyl-1,3-dithiolane

[Synonym ]:
2-phenyl-2-methyl-1,3-diothiolane
NCOLUSQXCWLHEK-UHFFFAOYSA
2-methylphenyl-1,3-dithiolane
1,3-DITHIOLANE,2-METHYL-2-PHENYL
acetophenone dithioketal
2-phenyl-2-methyl-1,3-dithiolane

Chemical & Physical Properties

[ Density]:
1.152g/cm3

[ Boiling Point ]:
305.2ºC at 760 mmHg

[ Molecular Formula ]:
C10H12S2

[ Molecular Weight ]:
196.33200

[ Flash Point ]:
141.6ºC

[ Exact Mass ]:
196.03800

[ PSA ]:
50.60000

[ LogP ]:
3.33930

[ Index of Refraction ]:
1.612

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
JP1170000
CHEMICAL NAME :
1,3-Dithiolane, 2-methyl-2-phenyl-
CAS REGISTRY NUMBER :
5769-02-8
LAST UPDATED :
199007
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H12-S2
MOLECULAR WEIGHT :
196.34
WISWESSER LINE NOTATION :
T5S CSTJ B1 BR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
400 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CHTPBA Chimica Therapeutica. (Paris, France) V.1-8, 1965-73. For publisher information, see EJMCA5. Volume(issue)/page/year: 5,327,1970

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1,2-Ethanedithiol
  • Acetophenone
  • Acetophenone ethylene ketal
  • 1,3-Dioxane,2-methyl-2-phenyl-
  • Acetophenone diethyl ketal
  • 1,1-ethane dithiol 1% in ethanol 94.5%/ethyl acetate 4%
  • 3-(1,3-dithiolan-2-ylidene)-2,4-pentanedione
  • Phenylacetylene
  • 2-methyl-2-phenyl-1,3-oxathiolane
  • (1,1,2,2-TETRAFLUOROETHOXY)BENZENE

DownStream

  • 1-ethylsulfanylethenylbenzene
  • Ethene, (ethylthio)-(9Cl)
  • 1-methylsulfanylethenylbenzene
  • METHYLVINYLTHIOETHER
  • 1,2-Ethanedithiol
  • Acetophenone
  • 1,1-difluoroethylbenzene
  • 5-phenyl-2,3-dihydro-1,4-dithiine
  • (S)-1-Phenylethanethiol
  • (E)-trimethyl(2-phenylprop-1-en-1-yl)silane

Related Compounds

  • 2-methyl-2-phenyl-1,3-dithiolane 1-oxide
  • 2-methyl-2-phenyl-1,3-dithiolane 1-oxide
  • 2-methyl-2-phenyl-1,3-benzoxathiole
  • 2-methyl-2-phenyl-1,3,5,6,8,8a-hexahydroindolizin-7-one
  • 2-Methyl-2-phenyl-1,3-oxathiolane-5-methanol carbamate
  • 2-methyl-2-phenyl-1,3-benzodithiole
  • 3-Bromo-1H-pyrrolo[3,2-c]pyridine-6-carboxylic acid
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 3-(4-Methoxy-2-nitrophenyl)butan-1-amine
  • 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)-
  • 1-(2,4-Difluorophenyl)-3-methylbutan-1-amine hydrochloride
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • 2,5-dichloro-N-(2-(pyrrolidin-1-ylsulfonyl)phenyl)pyrimidin-4-amine
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide