6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-2lambda~5~-isophosphinolin-2-one
Basic information
- CAS
89815-76-9- Standard SMILES
COc1cc2c(cc1OC)CP(C)(=O)CC2- InChIKey
OLEOCMNNFNYNSS-UHFFFAOYSA-N- Molecular formula
- C12H17O3P
- Average molar mass
- 240.23 g/mol
- Monoisotopic mass
- 240.0915314
Names & identifiers
- Preferred name
- 6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-2lambda~5~-isophosphinolin-2-one
- IUPAC
- 6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isophosphinoline 2-oxide
Names & synonyms
89815-76-9DTXSID905381206,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-2lambda~5~-isophosphinolin-2-one
Database identifiers
- CAS
89815-76-9- PubChem CID
- 13356972
- DTXSID
DTXSID90538120
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 292
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Compound notes
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