Basic information
- CAS
67343-01-5- Standard SMILES
CCCCCCCCCc1cc(=O)[nH]c(=O)[nH]1- InChIKey
QLWPACREJPPKAN-UHFFFAOYSA-N- Molecular formula
- C13H22N2O2
- Average molar mass
- 238.33 g/mol
- Monoisotopic mass
- 238.16812795
Names & identifiers
- Preferred name
- 6-nonyl-1H-pyrimidine-2,4-dione
- IUPAC
- 6-nonyl-1H-pyrimidine-2,4-dione
Names & synonyms
NSC36387467343-01-5NSC 363874DTXSID703207276-Nonylpyrimidine-2,4(1H,3H)-dioneNSC-363874
Database identifiers
- CAS
67343-01-5- PubChem CID
- 338993
- DTXSID
DTXSID70320727
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 298
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…