Basic information
- CAS
28900-62-1- Standard SMILES
CC(C)=CC1C(C(=O)OCc2ccccc2)C1(C)C- InChIKey
KIODTPOSZZYFIX-UHFFFAOYSA-N- Molecular formula
- C17H22O2
- Average molar mass
- 258.35 g/mol
- Monoisotopic mass
- 258.16197994
Names & identifiers
- Preferred name
- Benzyl 2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropane-1-carboxylate
- IUPAC
- benzyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Names & synonyms
28900-62-1Benzyl 2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropane-1-carboxylateBenzylchrysanthemateBENZYL-T-CHYRSANTHEMATESCHEMBL523193DTXSID70324003DTXSID70878213NSC405421NSC-405421
Database identifiers
- CAS
28900-62-1、64312-78-3- PubChem CID
- 347010
- DTXSID
DTXSID70324003- Nikkaji
- J476.520F
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 357
Experimental & physicochemical properties
LogP5.49
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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