Basic information
- CAS
6333-19-3- Standard SMILES
COC(=O)CCc1[nH]c(=O)[nH]c1C(=O)OC- InChIKey
VALGHEDNXDBWCU-UHFFFAOYSA-N- Molecular formula
- C9H12N2O5
- Average molar mass
- 228.2 g/mol
- Monoisotopic mass
- 228.07462149
Names & identifiers
- Preferred name
- Methyl 5-(3-methoxy-3-oxopropyl)-2-oxo-2,3-dihydro-1h-imidazole-4-carboxylate
- IUPAC
- methyl 5-(3-methoxy-3-oxopropyl)-2-oxo-1,3-dihydroimidazole-4-carboxylate
Names & synonyms
6333-19-3methyl 5-(3-methoxy-3-oxopropyl)-2-oxo-2,3-dihydro-1h-imidazole-4-carboxylateNSC38677DTXSID40284721NSC-38677
Database identifiers
- CAS
6333-19-3- PubChem CID
- 236294
- DTXSID
DTXSID40284721
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 93.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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