5-Benzyl-3-furylmethyl (-)-cis-chrysanthemate

HCID 39659

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Basic information

CAS: 50389-86-1
Standard SMILES: CC(C)=C[C@H]1[C@@H](C(=O)OCc2ccc(Cc3ccccc3)o2)C1(C)C
InChIKey: SSUJIHXQXFBEJN-PMACEKPBSA-N
Molecular formula: C22H26O3
Average molar mass: 338.4 g/mol
Monoisotopic mass: 338.18819469

Names & identifiers

Preferred name: 5-Benzyl-3-furylmethyl (-)-cis-chrysanthemate
IUPAC: trans-(5-benzylfuran-2-yl)methyl (1R,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate

Names & synonyms

5-Benzyl-3-furylmethyl (-)-cis-chrysanthemateRefChem:1072664(-)-cis-Resmethrin50389-86-1Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, (5-benzyl-3-furyl)methyl ester, (-)-(Z)-SSUJIHXQXFBEJN-PMACEKPBSA-NDTXSID601351612NS00125425

Database identifiers

CAS: 50389-86-1
PubChem CID: 39659
DTXSID: DTXSID601351612

Properties

Computed structural properties

XLogP: 6.5
Topological polar surface area: 39.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 7
Heavy atoms: 25
Formal charge: 0
Complexity: 497

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