2-crotonyloxymethyl-(4R,5R,6R)-4,5,6-trihydroxycyclohex- 2-enone

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Names

[ CAS No. ]:
62532-49-4

[ Name ]:
2-crotonyloxymethyl-(4R,5R,6R)-4,5,6-trihydroxycyclohex- 2-enone

Chemical & Physical Properties

[ Density]:
1.43g/cm3

[ Boiling Point ]:
420.3ºC at 760 mmHg

[ Molecular Formula ]:
C11H14O6

[ Molecular Weight ]:
242.22500

[ Flash Point ]:
163.3ºC

[ Exact Mass ]:
242.07900

[ PSA ]:
104.06000

[ Index of Refraction ]:
1.59

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GW7360000
CHEMICAL NAME :
2-Cyclohexen-1-one, 2-(hydroxymethyl)-4R,5R,6R-trihydroxy-, 2-ester with (E)-crotonic acid
CAS REGISTRY NUMBER :
62532-49-4
LAST UPDATED :
198609
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H14-O6
MOLECULAR WEIGHT :
242.25
WISWESSER LINE NOTATION :
L6V BUTJ B1OV1U2 DQ EQ FQ

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 :
90 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85GDA2 "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980- Volume(issue)/page/year: 6,65,1981

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 4-Chloro-5-(cyanomethyl)-6-(difluoromethyl)nicotinonitrile
  • 4-Chloro-5-iodo-2-phenylpyridine
  • 4-Bromo-2-cyano-5-methoxybenzenesulfonyl chloride
  • 4-Chloro-6-hydroxy-1H-indole-3-carbaldehyde
  • 4-Cyano-5-(difluoromethyl)-2-iodopyridine-3-methanol
  • 4-Fluoro-6-(2,3,4-trichlorophenyl)indole-3-carboxaldehyde
  • 4-Cyano-5-(difluoromethyl)-2-methoxy-3-nitropyridine
  • 4-Chloro-6-(difluoromethyl)-2-methylnicotinonitrile
  • 4-Cyano-5-(difluoromethyl)nicotinoyl chloride
  • 3-(Aminomethyl)-2-(difluoromethyl)-6-methylpyridin-4-amine
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