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Basic information
- Standard SMILES
C=C1C(=O)OC2C1C(OC(C)=O)CC(C)(O)C1CCC(C)C21- InChIKey
OJKCRFRTPJLEBQ-UHFFFAOYSA-N- Molecular formula
- C17H24O5
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.16237386
Names & identifiers
- Preferred name
- Dihydropyrethrosin
- IUPAC
- (6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6a,7,8,9,9a,9b-octahydro-3aH-azuleno[4,5-b]furan-4-yl) acetate
Names & synonyms
NSC407031DihydropyrethrosinPYRETHROSIN, DIHYDRO-NSC-407031
Database identifiers
- PubChem CID
- 348019
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 527
Related reactions
0 records
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Compound notes
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