Basic information
- CAS
406470-79-9- Standard SMILES
COC(=O)c1ccc(COc2cc(C)cc(C)c2)o1- InChIKey
GADCDXNDOZCRHK-UHFFFAOYSA-N- Molecular formula
- C15H16O4
- Average molar mass
- 260.28 g/mol
- Monoisotopic mass
- 260.10485899
Names & identifiers
- Preferred name
- Methyl 5-[(3,5-dimethylphenoxy)methyl]-2-furancarboxylate
- IUPAC
- methyl 5-[(3,5-dimethylphenoxy)methyl]furan-2-carboxylate
Names & synonyms
406470-79-9Methyl 5-[(3,5-dimethylphenoxy)methyl]-2-furancarboxylateMethyl 5-((3,5-dimethylphenoxy)methyl)-2-furancarboxylateRefChem:355887methyl 5-[(3,5-dimethylphenoxy)methyl]furan-2-carboxylatemethyl 5-((3,5-dimethylphenoxy)methyl)furan-2-carboxylateChemDiv3_006085DTXSID801196052HMS1490E13STK825443AKOS001682492CCG-116642
Show more names
IDI1_023995methyl 5-[(3,5-dimethylphenoxy)methyl]-2-furoateBRD-K73034951-001-01-3
Database identifiers
- CAS
406470-79-9- PubChem CID
- 890822
- DTXSID
DTXSID801196052
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 48.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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