Bis(tert-butyl) 1,4-dihydro-2,6-dimethyl-4-propylpyridine-3,5-dicarboxylate
Basic information
- CAS
94266-07-6- Standard SMILES
CCCC1C(C(=O)OC(C)(C)C)=C(C)NC(C)=C1C(=O)OC(C)(C)C- InChIKey
XGZQMGKQSIMQSW-UHFFFAOYSA-N- Molecular formula
- C20H33NO4
- Average molar mass
- 351.5 g/mol
- Monoisotopic mass
- 351.24095853
Names & identifiers
- Preferred name
- Bis(tert-butyl) 1,4-dihydro-2,6-dimethyl-4-propylpyridine-3,5-dicarboxylate
- IUPAC
- ditert-butyl 2,6-dimethyl-4-propyl-1,4-dihydropyridine-3,5-dicarboxylate
- English name
- bis(tert-butyl) 1,4-dihydro-2,6-dimethyl-4-propylpyridine-3,5-dicarboxylate
- Molecular formula
- C20H33NO4
- Molecular weight
- 351.48032
Names & synonyms
94266-07-6Bis(tert-butyl) 1,4-dihydro-2,6-dimethyl-4-propylpyridine-3,5-dicarboxylateEINECS 304-414-5DTXSID80241318XGZQMGKQSIMQSW-UHFFFAOYSA-NAKOS024373748di-tert-butyl 2,6-dimethyl-4-propyl-1,4-dihydropyridine-3,5-dicarboxylateNS00040351ST51012681tert-butyl 5-[(tert-butyl)oxycarbonyl]-2,6-dimethyl-4-propyl-1,4-dihydropyridi ne-3-carboxylateditert-butyl 2,6-dimethyl-4-propyl-1,4-dihydropyridine-3,5-dicarboxylate3,5-di-tert-butyl 2,6-dimethyl-4-propyl-1,4-dihydropyridine-3,5-dicarboxylate
Show more names
1,4-Dihydro-2,6-dimethyl-4-propyl-3,5-pyridinedicarboxylic acid bis(tert-butyl) ester
Database identifiers
- CAS
94266-07-6- PubChem CID
- 216403
- DTXSID
DTXSID80241318- EC Number
- 304-414-5
- Nikkaji
- J382.702J
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 550
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Compound notes
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