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Substance Name: Octahydrocoumarin
RN: 4430-31-3
UNII: H6VNF31DVW
InChIKey: MSFLYJIWLHSQLG-UHFFFAOYSA-N
Classification Code
- Skin / Eye Irritant
Molecular Formula
- C9-H14-O2
Molecular Weight
- 154.208
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Names and Synonyms
Name of Substance
- Octahydrocoumarin
Synonyms
- 2H-1-Benzopyran-2-one, octahydro-
- AI3-28142
- Bicyclononalactone
- Coumarin, octahydro-
- Cyclohexyl lactone
- Cyclohexyllactone
- EINECS 224-623-4
- FEMA No. 3791
- Octahydro-1-benzopyran-2-one
- Octahydro-2H-1-benzopyran-2-one
- Octahydrocoumarin
- UNII-H6VNF31DVW
Systematic Names
- 2H-1-Benzopyran-2-one, octahydro-
- Coumarin, octahydro-
- Octahydro-2H-1-benzopyran-2-one
Superlist Name
- Octahydrocoumarin
Registry Numbers
CAS Registry Number
- 4430-31-3
FDA UNII
- H6VNF31DVW
System Generated Number
- 0004430313
Structure Descriptors
InChI
InChI=1S/C9H14O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h7-8H,1-6H2InChIKey
MSFLYJIWLHSQLG-UHFFFAOYSA-NSmiles
O=C1CCC2CCCCC2O1Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rabbit | LD50 | skin | 3500mg/kg (3500mg/kg) | Food and Chemical Toxicology. Vol. 20, Pg. 781, 1982. | |
| rat | LD50 | oral | 3900mg/kg (3900mg/kg) | Food and Chemical Toxicology. Vol. 20, Pg. 781, 1982. |