Benzene,1-methyl-4-(2-propen-1-ylsulfonyl)-

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Names

[ CAS No. ]:
3112-87-6

[ Name ]:
Benzene,1-methyl-4-(2-propen-1-ylsulfonyl)-

[Synonym ]:
allyl 4-tolyl sulfone
CH2=CHCH2SO2C6H4Me-4
Sulfone,allyl p-tolyl
Allyl p-tolyl sulfone
p-Tolyl allyl sulfone

Chemical & Physical Properties

[ Density]:
1.117g/cm3

[ Boiling Point ]:
335.6ºC at 760mmHg

[ Molecular Formula ]:
C10H12O2S

[ Molecular Weight ]:
196.26600

[ Flash Point ]:
186.6ºC

[ Exact Mass ]:
196.05600

[ PSA ]:
42.52000

[ LogP ]:
3.03550

[ Index of Refraction ]:
1.525

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
WR2450000
CHEMICAL NAME :
Sulfone, allyl p-tolyl
CAS REGISTRY NUMBER :
3112-87-6
BEILSTEIN REFERENCE NO. :
1909845
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H12-O2-S
MOLECULAR WEIGHT :
196.28
WISWESSER LINE NOTATION :
2U1SWR D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
62500 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,375,1954

Safety Information

[ HS Code ]:
2904100000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Sodium toluene-4-sulphinate
  • allyl bromide
  • Allyl acetate
  • Benzene,1-methyl-4-(2-propen-1-ylthio)-
  • Tosyl chloride
  • Tosyl cyanide
  • p-bromobenzyl allyl sulfone
  • ALLYL CHLORIDE
  • p-toluenesulfonyl fluoride
  • Sodium p-toluenesulfonate

DownStream

  • Ethyl allylmalonate
  • Diethyl diallylmalonate
  • 4-Methylbenzenesulfinic acid
  • Allyl alcohol
  • Allylbenzene
  • P-toluenethiol
  • 1-Methyl-4-(methylsulfonyl)benzene
  • 1-methyl-4-[(E)-prop-1-enyl]sulfonylbenzene
  • 1-(4-methylphenylsulfonyl)propan-2-ol
  • ch3cho

Customs

[ HS Code ]: 2904100000

[ Summary ]:
2904100000 derivatives containing only sulpho groups, their salts and ethyl esters。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

Related Compounds

  • Benzene,1-methyl-4-(2-propen-1-yloxy)-
  • Benzene,1-methyl-4-(2-propen-1-ylthio)-
  • Benzene,1-chloro-4-(2-propen-1-ylsulfonyl)-
  • Benzene, 1-methyl-4-[[3-(methylthio)-2-propen-1-yl]sulfonyl]
  • Benzene, 1-methyl-4-[[(2E)-3-phenyl-2-propen-1-yl]thio]
  • Benzene, 1-methyl-4-[[(2E)-3-phenyl-2-propen-1-yl]sulfinyl]