Cas no 101392-31-8 (3-Pyridinecarboxamide, N-acetyl-1,2-dihydro-2-oxo-)
101392-31-8 structure
Product Name:3-Pyridinecarboxamide, N-acetyl-1,2-dihydro-2-oxo-
CAS No:101392-31-8
MF:C8H8N2O3
MW:180.16072177887
CID:1131728
PubChem ID:13466162
Update Time:2025-04-20
3-Pyridinecarboxamide, N-acetyl-1,2-dihydro-2-oxo- Chemical and Physical Properties
Names and Identifiers
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- 3-Pyridinecarboxamide, N-acetyl-1,2-dihydro-2-oxo-
- N-acetyl-2-oxo-1H-pyridine-3-carboxamide
- 101392-31-8
- DTXSID40541548
- N-Acetyl-2-oxo-1,2-dihydropyridine-3-carboxamide
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- Inchi: 1S/C8H8N2O3/c1-5(11)10-8(13)6-3-2-4-9-7(6)12/h2-4H,1H3,(H,9,12)(H,10,11,13)
- InChI Key: KSQOBAULIYDSMW-UHFFFAOYSA-N
- SMILES: O=C1C(C(NC(C)=O)=O)=CC=CN1
Computed Properties
- Exact Mass: 331.10835
- Monoisotopic Mass: 180.05349212g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 328
- 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
- Topological Polar Surface Area: 75.3?2
Experimental Properties
- PSA: 75.27
- LogP: 0.90380
3-Pyridinecarboxamide, N-acetyl-1,2-dihydro-2-oxo- Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
101392-31-8 (3-Pyridinecarboxamide, N-acetyl-1,2-dihydro-2-oxo-) Related Products
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