Basic information
- CAS
59026-31-2- Standard SMILES
CCCC1(c2ccccc2)C(=O)NCNC1=O- InChIKey
ALFVJJCIRTZPFC-UHFFFAOYSA-N- Molecular formula
- C13H16N2O2
- Average molar mass
- 232.28 g/mol
- Monoisotopic mass
- 232.12117776
Names & identifiers
- Preferred name
- Dihydro-5-phenyl-5-propyl-4,6(1H,5H)-pyrimidinedione
- IUPAC
- 5-phenyl-5-propyl-1,3-diazinane-4,6-dione
- English name
- Dihydro-5-phenyl-5-propyl-4,6(1H,5H)-pyrimidinedione
- Molecular formula
- C13H16N2O2
- Molecular weight
- 232.28
Names & synonyms
59026-31-2Dihydro-5-phenyl-5-propyl-4,6(1H,5H)-pyrimidinedione5-phenyl-5-propyl-1,3-diazinane-4,6-dione5-Phenyl-5-propyldihydropyrimidine-4,6(1H,5H)-dione5-Phenyl-5-propyldihydro-4,6(1H,5H)-pyrimidinedioneNSC364165DTXSID40320779ALFVJJCIRTZPFC-UHFFFAOYSA-NAKOS024318877NSC-364165DB-053304ST50406468
Show more names
5-Phenyl-5-propyl-2,3-dihydropyrimidine-4,6(1H,5H)-dione5-(1-cyclohexa-2,4-dienyl)-5-propyl-1H-pyrimidine-4,6-dioneDIHYDRO-5-PHENYL-5-PROPYL-4,6(1H.5H)- PYRIMIDINEDIONE, 99+%
4,5H)-Pyrimidinedione, dihydro-5-phenyl-5-propyl-5-Phenyl-5-propyldihydro-4,6(1H,5H)-pyrimidinedione #4,6(1H,5H)-Pyrimidinedione, dihydro-5-phenyl-5-propyl-5-phenyl-5-propyl-1,2,3,5-tetrahydropyrimidine-4,6-dione
Database identifiers
- CAS
59026-31-2- PubChem CID
- 339141
- DTXSID
DTXSID40320779- Nikkaji
- J236.625H
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 293
Physicochemical properties
- Melting point
- 308 · 308-309 °C
- Boiling point
- 374.44 °C · 374.44°C (rough estimate)
- Density
- 1.1099 · 1.1099 (rough estimate)
- refractive index
- 1.645 · 1.6450 (estimate)
- pka
- 12.263 · 12.263±0.40(predicted)
- Safety Statements
- 24 · 24/25
- HS Code
- 29335995 · 29335995
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 29335995
- safety_code
- 24/25
Chemistry & industry
Suppliers3 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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