1-(1-Butoxyethyl)-5-chloropyrimidine-2,4-dione
Basic information
- CAS
6054-30-4- Standard SMILES
CCCCOC(C)n1cc(Cl)c(=O)[nH]c1=O- InChIKey
FXBDLZPRXMFFKM-UHFFFAOYSA-N- Molecular formula
- C10H15ClN2O3
- Average molar mass
- 246.69 g/mol
- Monoisotopic mass
- 246.07712
Names & identifiers
- Preferred name
- 1-(1-Butoxyethyl)-5-chloropyrimidine-2,4-dione
- IUPAC
- 1-(1-butoxyethyl)-5-chloropyrimidine-2,4-dione
Names & synonyms
6054-30-41-(1-butoxyethyl)-5-chloro-2,4(1H,3H)-pyrimidinedione1-(1-butoxyethyl)-5-chloropyrimidine-2,4(1H,3H)-dioneAJ-292/141220031-(1-butoxyethyl)-5-chloropyrimidine-2,4-dioneCBMicro_004042DTXSID10389656SMSF0012573STK995720AKOS000549787AKOS022089439CB05901
Show more names
CCG-108149BIM-0003958.P001ST50741773SR-01000453428SR-01000453428-11-(1-BUTOXYETHYL)-5-CHLORO-3H-PYRIMIDINE-2,4-DIONE
Database identifiers
- CAS
6054-30-4- PubChem CID
- 3133608
- DTXSID
DTXSID10389656
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 317
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Compound notes
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