Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (3-methylphenyl)methyl ester, (1R,3R)-
Basic information
- CAS
82535-25-9- Standard SMILES
CC(C)=C[C@@H]1[C@@H](C(=O)OCc2cccc(C)c2)C1(C)C- InChIKey
DQMRZPKGQKXLPJ-CVEARBPZSA-N- Molecular formula
- C18H24O2
- Average molar mass
- 272.4 g/mol
- Monoisotopic mass
- 272.17763
Names & identifiers
- Preferred name
- Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (3-methylphenyl)methyl ester, (1R,3R)-
- IUPAC
- cis-(3-methylphenyl)methyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Names & synonyms
82535-25-9Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (3-methylphenyl)methyl ester, (1R,3R)-DTXSID80231830(3-methylphenyl)methyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropane-1-carboxylate
Database identifiers
- CAS
82535-25-9- PubChem CID
- 158155
- DTXSID
DTXSID80231830- Nikkaji
- J246.592B
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 390
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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