Octahydrochromen-2-one

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Names

[ CAS No. ]:
4430-31-3

[ Name ]:
Octahydrochromen-2-one

[Synonym ]:
Octahydrochromen-2-one
FEMA No. 3791
Octahydrocoumarin
Octahydro-2H-chromen-2-one
octahydro-2H-1-benzopyran-2-one
2H-1-Benzopyran-2-one, octahydro-
2H-1-Benzopyran-2-one,octahydro
Octahydro-1-benzopyran-2-one
hexahydrocoumarin
Cyclohexyl lactone
1-oxadecal-2-one
COUMARIN,OCTAHYDRO
Bicyclononalactone
EINECS 224-623-4

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
273.1±8.0 °C at 760 mmHg

[ Molecular Formula ]:
C9H14O2

[ Molecular Weight ]:
154.206

[ Flash Point ]:
109.0±15.9 °C

[ Exact Mass ]:
154.099380

[ PSA ]:
26.30000

[ LogP ]:
1.35

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.478

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GN8261500
CHEMICAL NAME :
Coumarin, octahydro-
CAS REGISTRY NUMBER :
4430-31-3
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C9-H14-O2
MOLECULAR WEIGHT :
154.23

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,781,1982 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3900 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,781,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
3500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,781,1982

Safety Information

[ WGK Germany ]:
2

[ RTECS ]:
GN8261500

Precursor & DownStream

Precursor

DownStream

  • 3-CYCLOHEXYL-1-PROPANOL
  • 2-(3-hydroxypropyl)cyclohexan-1-ol
  • 2,3,4,5,6,7-Hexahydro-1H-indene-1-one
  • Cyclohexanepropanoicacid,1-hydroxy-,gamma-lactone

Related Compounds

  • octahydrochromen-2-one
  • 6-tert-butyl-3,4,4a,5,6,7,8,8a-octahydrochromen-2-one
  • Coumaraz-2-one
  • hexan-2-one
  • azepan-2-one,ethane-1,2-diol,5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane
  • azepan-2-one,decanedioic acid,dodecanedioic acid,hexane-1,6-diamine
  • (E)-6-(but-2-en-2-yl)-2-methylpyrimidin-4-ol
  • 6-(2-Fluorobenzyl)-2-methylpyrimidin-4-ol
  • 3-(3,3,3-Trifluoro-2-hydroxy-2-methylpropyl)pyrrolidin-2-one
  • Tert-butyl 2-cyclopropyl-5-methoxy-6-oxo-1,6-dihydropyrimidine-4-carboxylate
  • 5-Methyl-2-(1,2,3,6-tetrahydropyridin-1-yl)pyrimidine
  • (1-isopropyl-6-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl)methanol
  • 1-isopropyl-6-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
  • (5-(1H-pyrrol-2-yl)-1,2,4-oxadiazol-3-yl)methanamine
  • 2,6-Dibromo-3-(difluoromethyl)pyridine
  • 5-(1-(3,5-dichloropyridin-4-yl)ethoxy)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazole-3-carbaldehyde
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