Basic information
- CAS
82946-66-5- Standard SMILES
CC1(C)COC(c2cccc3c2C2C=CC3O2)=N1- InChIKey
HGCVTPAJCGQGDN-UHFFFAOYSA-N- Molecular formula
- C15H15NO2
- Average molar mass
- 241.28 g/mol
- Monoisotopic mass
- 241.11027872
Names & identifiers
- Preferred name
- 695VP95Fyv
- IUPAC
- 4,4-dimethyl-2-(11-oxatricyclo[6.2.1.02,7]undeca-2(7),3,5,9-tetraen-3-yl)-5H-1,3-oxazole
Names & synonyms
NSC-365336NSC365336695VP95FYVDTXSID1010030162-(1,4-Dihydro-1,4-epoxynaphthalen-5-yl)-4,5-dihydro-4,4-dimethyloxazole2-(1,4-Dihydro-1,4-epoxynaphthalen-5-yl)-4,4-dimethyl-4,5-dihydro-1,3-oxazoleOxazole, 2-(1,4-dihydro-1,4-epoxynaphthalen-5-yl)-4,5-dihydro-4,4-dimethyl-4,4-dimethyl-2-{11-oxatricyclo[6.2.1.0{2,7}]undeca-2(7),3,5,9-tetraen-3-yl}-4,5-dihydro-1,3-oxazole
Database identifiers
- CAS
82946-66-5- PubChem CID
- 339283
- DTXSID
DTXSID101003016- UNII
- 695VP95FYV
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 30.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 426
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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