Basic information
- CAS
27850-30-2- Standard SMILES
C#CCOCC1COC(=O)C1Cc1ccc(F)cc1- InChIKey
ZDZYVGFZODKQCD-UHFFFAOYSA-N- Molecular formula
- C15H15FO3
- Average molar mass
- 262.28 g/mol
- Monoisotopic mass
- 262.1005225
Names & identifiers
- Preferred name
- 2(3H)-Furanone, dihydro-3-(p-fluorobenzyl)-5-(2-propynyloxymethyl)-
- IUPAC
- 3-[(4-fluorophenyl)methyl]-4-(prop-2-ynoxymethyl)oxolan-2-one
- English name
- 3-[(4-Fluorophenyl)methyl]-4,5-dihydro-5-[(2-propynyloxy)methyl]-2(3H)-furanone
- Molecular formula
- C15H15FO3
- Molecular weight
- 262.28
Names & synonyms
BRN 158974327850-30-2Dihydro-3-(p-fluorobenzyl)-5-(2-propynyloxymethyl)-2(3H)-furanonePropargyloxymethyl-4 p-fluorobenzyl-2 gamma-butyrolactonegamma-Butyrolactone, 2-(p-fluorobenzyl)-4-(2-propynyloxymethyl)-2(3H)-FURANONE, DIHYDRO-3-(p-FLUOROBENZYL)-5-(2-PROPYNYLOXYMETHYL)-RefChem:241635DTXSID309505243-[(4-Fluorophenyl)methyl]-4-{[(prop-2-yn-1-yl)oxy]methyl}oxolan-2-one3-[(4-Fluorophenyl)methyl]-4,5-dihydro-5-[(2-propynyloxy)methyl]-2(3H)-furanone2(3H)-Furanone, 3-[(4-fluorophenyl)methyl]dihydro-5-[(2-propynyloxy)methyl]- (9CI)
Database identifiers
- CAS
27850-30-2- PubChem CID
- 34045
- DTXSID
DTXSID30950524
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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