tert-Butyl 4-(pyrimidin-4-yl)piperazine-1-carboxylate hydrochloride
Basic information
- CAS
634468-87-4- Standard SMILES
CC(C)(C)OC(=O)N1CCN(c2ccncn2)CC1.Cl- InChIKey
NDRUXAAEJIXVPK-UHFFFAOYSA-N- Molecular formula
- C13H21ClN4O2
- Average molar mass
- 300.78 g/mol
- Monoisotopic mass
- 300.1353036
Names & identifiers
- Preferred name
- tert-Butyl 4-(pyrimidin-4-yl)piperazine-1-carboxylate hydrochloride
- IUPAC
- tert-butyl 4-pyrimidin-4-ylpiperazine-1-carboxylate;hydrochloride
Names & synonyms
634468-87-44-(4-BOC-PIPERAZINO)PYRIMIDINE HCLtert-Butyl 4-(pyrimidin-4-yl)piperazine-1-carboxylate hydrochloridetert-butyl 4-pyrimidin-4-ylpiperazine-1-carboxylate;hydrochloride4-(4-BOC-Piperazino)pyrimidine hydrochlorideMFCD26131138BS-32652tert-Butyl4-(pyrimidin-4-yl)piperazine-1-carboxylatehydrochloride1-Piperazinecarboxylic acid, 4-(4-pyrimidinyl)-, 1,1-dimethylethyl ester,monohydrochloride
Database identifiers
- CAS
634468-87-4- PubChem CID
- 74889709
Properties
Computed structural properties
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 308
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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