Basic information
- CAS
63194-78-5- Standard SMILES
COc1ccc(Cc2cc3c(cc2O)OCO3)cc1- InChIKey
VICOPQCDYYEYMV-UHFFFAOYSA-N- Molecular formula
- C15H14O4
- Average molar mass
- 258.27 g/mol
- Monoisotopic mass
- 258.08920892
Names & identifiers
- Preferred name
- 6-[(4-Methoxyphenyl)methyl]-2H-1,3-benzodioxol-5-ol
- IUPAC
- 6-[(4-methoxyphenyl)methyl]-1,3-benzodioxol-5-ol
Names & synonyms
63194-78-56-[(4-Methoxyphenyl)methyl]-2H-1,3-benzodioxol-5-olNSC2691286-(4-Methoxybenzyl)benzo[d][1,3]dioxol-5-olSCHEMBL11081351SCHEMBL30885583DTXSID90313338VICOPQCDYYEYMV-UHFFFAOYSA-NNSC-269128OBTUSAQUINONE DERIV JURD 23376-(4-methoxybenzyl)-3,4-methylenedioxyphenol
Database identifiers
- CAS
63194-78-5- PubChem CID
- 320683
- DTXSID
DTXSID90313338- Nikkaji
- J3.139.264K
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 288
Related reactions
3 records
Compound notes
Loading…