Basic information
- CAS
92554-42-2- Standard SMILES
COC(=O)Cc1oc(=O)n(-c2ccccc2)c(=O)c1C(=O)OC- InChIKey
HRHTUOXPCWKFKW-UHFFFAOYSA-N- Molecular formula
- C15H13NO7
- Average molar mass
- 319.27 g/mol
- Monoisotopic mass
- 319.06920175
Names & identifiers
- Preferred name
- Methyl 6-(2-methoxy-2-oxoethyl)-2,4-dioxo-3-phenyl-3,4-dihydro-2H-1,3-oxazine-5-carboxylate
- IUPAC
- methyl 6-(2-methoxy-2-oxoethyl)-2,4-dioxo-3-phenyl-1,3-oxazine-5-carboxylate
Names & synonyms
92554-42-2NSC202691DTXSID10308201NSC-202691Methyl 6-(2-methoxy-2-oxoethyl)-2,4-dioxo-3-phenyl-3,4-dihydro-2H-1,3-oxazine-5-carboxylateDS-011463methyl 6-(methoxycarbonylmethyl)-2,4-dioxo-3-phenyl-1,3-oxazine-5-carboxylate
Database identifiers
- CAS
92554-42-2- PubChem CID
- 305656
- DTXSID
DTXSID10308201
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 99.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 560
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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