Cas no 94071-56-4 ( )
structure
Product Name:
Chemical and Physical Properties
Names and Identifiers
-
- 2(1H)-Pyridinone, 1-methyl-, dimer
- AKOS006306699
- MFCD00006520
- M0412
- EINECS 211-777-2
- 1-Methyl-2-oxopyridine
- UNII-NY6MVO4K7R
- DS-14672
- 1-methyl-1,2-dihydropyridin-2-one
- EN300-122028
- F0001-1804
- InChI=1/C6H7NO/c1-7-5-3-2-4-6(7)8/h2-5H,1H
- 2(1H)-PYRIDONE, 1-METHYL-
- 1-methylpyridin-2-one
- N-Methylpyridone
- 1-Methyl-2-pyridinone
- NY6MVO4K7R
- N-Methyl-2-pyridone
- 1-Methyl-2(1H)-pyridone
- 1-Methylpyridine-2-one
- 1-methyl-1H-pyridin-2-one
- SY023863
- 1-Methyl-2(1H)-pyridinone
- 694-85-9
- 1-Methyl-1,2-dihydro-2-pyridinone
- AC-907/25014126
- CHEMBL12607
- AKOS015891684
- DTXSID8061008
- A9192
- BRN 0107805
- 1-methylpyridin-1-ium-2-ol
- 859803-97-7
- NSC9383
- 5-21-07-00109 (Beilstein Handbook Reference)
- NSC-176168
- NS00036863
- SCHEMBL9496826
- NSC 9383
- FT-0632827
- 2(1H)-Pyridinone, 1-methyl-
- AI3-11540
- N-methylpyridinium oxide
- 1-Methyl-2-pyridone
- N-Methyl-2-pyridone, >=99%
- CHEBI:194916
- Pyridinium,2-hydroxy-1-methyl-,inner salt
- 94071-56-4
- 1-methylpyridin-2(1H)-one
- NSC176168
- NSC-9383
- SCHEMBL17685
- CS-0063949
- SCHEMBL25572898
- DB-019243
-
-
- Inchi： 1S/C6H7NO/c1-7-5-3-2-4-6(7)8/h2-5H,1H3
- InChI Key： DVVGIUUJYPYENY-UHFFFAOYSA-N
- SMILES： O=C1C=CC=CN1C
Computed Properties
- Exact Mass: 109.052763847g/mol
- Monoisotopic Mass: 109.052763847g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 158
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.2
- Topological Polar Surface Area: 20.3?2
Related Literature
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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