Basic information
- CAS
5254-72-8- Standard SMILES
COc1ccc(-c2coc3c4c(c(CC=C(C)C)c(OC)c3c2=O)OC(C)(C)C=C4)cc1- InChIKey
FMMGGNWIGINIOP-UHFFFAOYSA-N- Molecular formula
- C27H28O5
- Average molar mass
- 432.5 g/mol
- Monoisotopic mass
- 432.19367399
Names & identifiers
- Preferred name
- 5-Methoxy-3-(4-methoxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-en-1-yl)-4h,8h-pyrano[2,3-f]chromen-4-one
- IUPAC
- 5-methoxy-3-(4-methoxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-enyl)pyrano[2,3-h]chromen-4-one
Names & synonyms
NSC215665-methoxy-3-(4-methoxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-en-1-yl)-4h,8h-pyrano[2,3-f]chromen-4-one5254-72-8DTXSID90281407NSC-215665-methoxy-3-(4-methoxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-enyl)pyrano[2,3-h]chromen-4-one5-Methoxy-3-(4-methoxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-en-1-yl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
Database identifiers
- CAS
5254-72-8- PubChem CID
- 228559
- DTXSID
DTXSID90281407
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 782
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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