Dimethyl 3,6-bis(3-methoxy-3-oxopropyl)pyrazine-2,5-dicarboxylate
Basic information
- CAS
6317-52-8- Standard SMILES
COC(=O)CCc1nc(C(=O)OC)c(CCC(=O)OC)nc1C(=O)OC- InChIKey
SCHGWJMTBHDNKP-UHFFFAOYSA-N- Molecular formula
- C16H20N2O8
- Average molar mass
- 368.34 g/mol
- Monoisotopic mass
- 368.1219656
Names & identifiers
- Preferred name
- Dimethyl 3,6-bis(3-methoxy-3-oxopropyl)pyrazine-2,5-dicarboxylate
- IUPAC
- dimethyl 3,6-bis(3-methoxy-3-oxopropyl)pyrazine-2,5-dicarboxylate
Names & synonyms
6317-52-8dimethyl 3,6-bis(3-methoxy-3-oxopropyl)pyrazine-2,5-dicarboxylateNSC39478DTXSID70284875NSC-39478Ethyl N-(hydroxy-yert.-butyl)-carbamatedimethyl 3,6-bis(3-methoxy-3-oxo-propyl)pyrazine-2,5-dicarboxylate
Database identifiers
- CAS
6317-52-8- PubChem CID
- 236706
- DTXSID
DTXSID70284875
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 12
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 478
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Compound notes
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