2(1H)-Pyridinone, 1,4,6-trimethyl-
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Basic information
- CAS
15031-89-7- Standard SMILES
Cc1cc(C)n(C)c(=O)c1- InChIKey
OZILNWNVMNXBDY-UHFFFAOYSA-N- Molecular formula
- C8H11NO
- Average molar mass
- 137.18 g/mol
- Monoisotopic mass
- 137.08406397
Names & identifiers
- Preferred name
- 2(1H)-Pyridinone, 1,4,6-trimethyl-
- IUPAC
- 1,4,6-trimethylpyridin-2-one
- English name
- 1,4,6-Trimethylpyridine-2(1H)-one
- Molecular formula
- C8H11NO
- Molecular weight
- 137.18
Names & synonyms
15031-89-72(1H)-Pyridinone, 1,4,6-trimethyl-2(1H)-Pyridone, 1,4,6-trimethyl-1,4,6-Trimethyl-2(1H)-pyridone1,4,6-Trimethyl-2-pyridoneDTXSID70342964RefChem:241236DTXCID60294044OZILNWNVMNXBDY-UHFFFAOYSA-N1,4,6-Trimethyl-1,2-dihydropyridin-2-one1,4,6-trimethylpyridin-2-one1,4,6-Trimethylpyridine-2(1H)-one
Show more names
1,4,6-trimethylpyridin-2(1H)-oneSCHEMBL4352507SCHEMBL85210711,4,6-Trimethyl-2(1H)-pyridinone #EN300-328844
Database identifiers
- CAS
15031-89-7- PubChem CID
- 586244
- DTXSID
DTXSID70342964- Nikkaji
- J101.232K
Properties
Computed structural propertiesFilling in
- XLogP
- 0.7
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 225
Physicochemical properties
- Boiling point
- 268.9 · 268.9±9.0 °C(Predicted)
- Density
- 1.004 · 1.004±0.06 g/cm3(Predicted)
- pka
- 1.27 · 1.27±0.62(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
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Compound notes
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