Basic information
- CAS
64681-48-7- Standard SMILES
CC1(C)C[C@](C)(c2ccc(O)cc2)c2ccccc2O1- InChIKey
KXYDGGNWZUHESZ-GOSISDBHSA-N- Molecular formula
- C18H20O2
- Average molar mass
- 268.3 g/mol
- Monoisotopic mass
- 268.14632988
Names & identifiers
- Preferred name
- A86K7DC2SY
- IUPAC
- 4-[(4R)-2,2,4-trimethyl-3H-chromen-4-yl]phenol
Names & synonyms
R-Dianin's CompoundDianin's Compound, (R)-A86K7DC2SY4-(p-hydroxyphenyl)-2,2,4-trimethylchromanR-4-p-hydroxyphenyl-2,2,4-trimethylchroman4-(3,4-Dihydro-2,2,4-trimethyl-2H-1-benzopyran-4-yl)phenol, (R)-4-[(4R)-3,4-Dihydro-2,2,4-trimethyl-2H-1-benzopyran-4-yl]phenolPhenol, 4-(3,4-dihydro-2,2,4-trimethyl-2H-1-benzopyran-4-yl)-, (R)-Phenol, 4-[(4R)-3,4-dihydro-2,2,4-trimethyl-2H-1-benzopyran-4-yl]-64681-48-7
Database identifiers
- CAS
64681-48-7- PubChem CID
- 827488
- UNII
- A86K7DC2SY
- Nikkaji
- J1.307.713D
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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