Tert-butyl 5-(hydroxymethyl)-8-oxo-2,7-diazaspiro[3.5]nonane-2-carboxylate
Basic information
- CAS
1357354-14-3- Standard SMILES
CC(C)(C)OC(=O)N1CC2(CC(=O)NCC2CO)C1- InChIKey
SPGUUROEUQFYBG-UHFFFAOYSA-N- Molecular formula
- C13H22N2O4
- Average molar mass
- 270.32 g/mol
- Monoisotopic mass
- 270.15795719
Names & identifiers
- Preferred name
- Tert-butyl 5-(hydroxymethyl)-8-oxo-2,7-diazaspiro[3.5]nonane-2-carboxylate
- IUPAC
- tert-butyl 5-(hydroxymethyl)-8-oxo-2,7-diazaspiro[3.5]nonane-2-carboxylate
Names & synonyms
DTXSID601118347TERT-BUTYL 5-(HYDROXYMETHYL)-8-OXO-2,7-DIAZASPIRO[3.5]NONANE-2-CARBOXYLATE1357354-14-32,7-Diazaspiro[3.5]nonane-2-carboxylic acid, 5-(hydroxymethyl)-8-oxo-, 1,1-dimethylethyl ester
Database identifiers
- CAS
1357354-14-3- PubChem CID
- 71305751
- DTXSID
DTXSID601118347
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 383
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Compound notes
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