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-(5-Amino-2-fluorophenyl)-2-chlorobenzamide
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • Phenylmethyl 2-isocyanatobenzoate
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1-(6-methoxy-2,2,4-trimethylquinolin-1(2H)-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone
  • 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