8-hydroxy-3-methyl-isochroman-1-one

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Names

[ CAS No. ]:
17397-85-2

[ Name ]:
8-hydroxy-3-methyl-isochroman-1-one

[Synonym ]:
(3R)-hydroxybutyl (3R)-hydroxybutyrate
3-hydroxybutyl-(R)-3-hydroxybutyrate
3,4-dihydro-8-hydroxy-3-methyl-1H-2-benzopyran-1-one
Ketone Ester
(3R)-mellein
8-Hydroxy-3-methyl-3,4-dihydro-1H-isochromen-1-one
(R)-3,4-dihydro-8-hydroxy-3-methylisochromen-1-one

Chemical & Physical Properties

[ Molecular Formula ]:
C10H10O3

[ Molecular Weight ]:
178.18500

[ Exact Mass ]:
178.06300

[ PSA ]:
46.53000

[ LogP ]:
1.49360

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NQ7860000
CHEMICAL NAME :
Isocoumarin, 3,4-dihydro-8-hydroxy-3-methyl-
CAS REGISTRY NUMBER :
17397-85-2
LAST UPDATED :
198909
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H10-O3
MOLECULAR WEIGHT :
178.20

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 :
125 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: 5,451,1981

Related Compounds

  • 8-Hydroxy-3-methyl-isochroman-1-one
  • 5,7-Bis-chloromethyl-8-hydroxy-3-methyl-isochroman-1-one
  • 8-hydroxy-3-methyl-7-propionyl-3,4-dihydro-1H-isochromen-1-one
  • (3R)-8-hydroxy-6-methoxy-3-methyl-isochroman-1-one
  • 5-hydroxymethylmellein
  • (+/-) kigelin
  • N-[[3-(3-Propyl-1,2,4-oxadiazol-5-yl)phenyl]methyl]prop-2-enamide
  • N-[1-[3-(Dimethylsulfamoyl)phenyl]ethyl]prop-2-enamide
  • N-[4-(2-Oxopyridin-1-yl)butyl]prop-2-enamide
  • N-[1-(1-Methyl-2-oxo-3H-indol-5-yl)ethyl]prop-2-enamide
  • N-[[1-(2-Methoxyethyl)pyrrolidin-3-yl]methyl]prop-2-enamide
  • N-[1-(2-Methoxyphenyl)-2-methylpropan-2-yl]prop-2-enamide
  • N-[3-(4-Fluorophenoxy)propyl]-N-(2-methoxyethyl)prop-2-enamide
  • N-[2-(3,4-Dihydro-2H-quinolin-1-yl)-2-oxoethyl]-N-methylprop-2-enamide
  • N-[(2S)-1-Oxo-1-piperidin-1-ylpropan-2-yl]prop-2-enamide
  • N-[1-(Cyclopropylmethyl)pyrrolidin-3-yl]prop-2-enamide
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