Basic information
- CAS
20460-09-7- Standard SMILES
COc1cccc(OC)c1C(c1c(OC)cccc1OC)c1c(OC)cccc1OC- InChIKey
WQLKKKUEDOXLAO-UHFFFAOYSA-N- Molecular formula
- C25H28O6
- Average molar mass
- 424.5 g/mol
- Monoisotopic mass
- 424.18858861
Names & identifiers
- Preferred name
- 1,1',1''-Methanetriyltris(2,6-dimethoxybenzene)
- IUPAC
- 2-[bis(2,6-dimethoxyphenyl)methyl]-1,3-dimethoxybenzene
Names & synonyms
20460-09-71,1',1''-methanetriyltris(2,6-dimethoxybenzene)2-[bis(2,6-dimethoxyphenyl)methyl]-1,3-dimethoxybenzeneNSC156512Methanol,6-dimethoxyphenyl)-Benzene, 1,1',1''-methylidynetris[2,6-dimethoxy-SCHEMBL1225350SCHEMBL13939459DTXSID90303072NSC-156512
Database identifiers
- CAS
20460-09-7- PubChem CID
- 291329
- DTXSID
DTXSID90303072- Nikkaji
- J671.517F
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 409
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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