Basic information
- CAS
26676-02-8- Standard SMILES
O=c1cc(C(F)(F)F)[nH]c(=O)n1-c1ccccc1- InChIKey
VDLYSLFSLYOAQU-UHFFFAOYSA-N- Molecular formula
- C11H7F3N2O2
- Average molar mass
- 256.18 g/mol
Names & identifiers
- Preferred name
- 3-phenyl-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione
- IUPAC
- 3-phenyl-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione
- English name
- 2-Hydroxy-3-phenyl-6-(trifluoromethyl)-4(3H)-pyrimidinone
- Molecular formula
- C11H7F3N2O2
- Molecular weight
- 256.18
Names & synonyms
26676-02-82-hydroxy-3-phenyl-6-(trifluoromethyl)-3,4-dihydropyrimidin-4-one3-phenyl-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione2-hydroxy-3-phenyl-6-(trifluoromethyl)-4(3H)-pyrimidinoneMFCD031025472-Hydroxy-3-phenyl-6-(trifluoromethyl)pyrimidin-4(3H)-oneSCHEMBL11785182VDLYSLFSLYOAQU-UHFFFAOYSA-NAKOS015993175CS-03592476T-02463-phenyl-6-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
Show more names
Lufenuron Impurity 9 (Fenuron)2,4(1H,3H)-Pyrimidinedione, 3-phenyl-6-(trifluoromethyl)-
Database identifiers
- CAS
26676-02-8
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 398
Physicochemical properties
- Density
- 1.463 · 1.463±0.06 g/cm3(Predicted)
- pka
- 6.71 · 6.71±0.40(Predicted)
- HS Code
- 2933599590 · 2933599590
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
- 2933599590
Chemistry & industry
Suppliers3 total
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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