Basic information
- CAS
80676-54-6- Standard SMILES
CCC(C)C1=NCCCN1- InChIKey
QXGVHVNNHKSENL-UHFFFAOYSA-N- Molecular formula
- C8H16N2
- Average molar mass
- 140.23 g/mol
- Monoisotopic mass
- 140.13134852
Names & identifiers
- Preferred name
- 2-Butan-2-yl-1,4,5,6-tetrahydropyrimidine
- IUPAC
- 2-butan-2-yl-1,4,5,6-tetrahydropyrimidine
Names & synonyms
80676-54-62-butan-2-yl-1,4,5,6-tetrahydropyrimidineNSC367611DTXSID00320992AKOS006356727NSC-3676112-(butan-2-yl)-1,4,5,6-tetrahydropyrimidine
Database identifiers
- CAS
80676-54-6- PubChem CID
- 339768
- DTXSID
DTXSID00320992
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 24.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 129
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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