Ethyl 1-methyl-6-oxopyrano[2,3-c]pyrazole-3-carboxylate
Basic information
- CAS
81292-17-3- Standard SMILES
CCOC(=O)c1nn(C)c2oc(=O)ccc12- InChIKey
ZWZAESFGXCNLLN-UHFFFAOYSA-N- Molecular formula
- C10H10N2O4
- Average molar mass
- 222.2 g/mol
- Monoisotopic mass
- 222.0640568
Names & identifiers
- Preferred name
- Ethyl 1-methyl-6-oxopyrano[2,3-c]pyrazole-3-carboxylate
- IUPAC
- ethyl 1-methyl-6-oxopyrano[3,2-d]pyrazole-3-carboxylate
Names & synonyms
81292-17-3ethyl 1-methyl-6-oxopyrano[2,3-c]pyrazole-3-carboxylateNSC356356DTXSID00320210NSC-356356Ethyl 1-methyl-6-oxo-1,6-dihydropyrano[2,3-c]pyrazole-3-carboxylate
Database identifiers
- CAS
81292-17-3- PubChem CID
- 337626
- DTXSID
DTXSID00320210
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 342
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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