Basic information
- Standard SMILES
CC1CNCCN(C(=O)OC(C)(C)C)C1C- InChIKey
JOWSEEBPBXTYNC-UHFFFAOYSA-N- Molecular formula
- C12H24N2O2
- Average molar mass
- 228.33 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 6,7-dimethyl-1,4-diazepane-1-carboxylate
- IUPAC
- tert-butyl 6,7-dimethyl-1,4-diazepane-1-carboxylate
Names & synonyms
tert-butyl 6,7-dimethyl-1,4-diazepane-1-carboxylate1149352-47-5SCHEMBL2880613JOWSEEBPBXTYNC-UHFFFAOYSA-NAT40153
Database identifiers
- PubChem CID
- 59527658
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 248
Related reactions
4 records
Compound notes
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