Cas no 88302-12-9 (2(1H)-Pyridinone, 6-methyl-5-(1-oxopropyl)-)
88302-12-9 structure
Product Name:2(1H)-Pyridinone, 6-methyl-5-(1-oxopropyl)-
CAS No:88302-12-9
MF:C9H11NO2
MW:165.189142465591
CID:638233
PubChem ID:13232041
Update Time:2025-04-19
2(1H)-Pyridinone, 6-methyl-5-(1-oxopropyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2(1H)-Pyridinone, 6-methyl-5-(1-oxopropyl)-
- 6-methyl-5-propanoyl-1H-pyridin-2-one
- SCHEMBL7377797
- 6-Methyl-5-propanoylpyridin-2(1H)-one
- 6-methyl-5-(n-propanoyl)-2-(1H)-pyridinone
- GWCNLYWJTUWLAR-UHFFFAOYSA-N
- 88302-12-9
- DTXSID20530551
- 6-methyl-5-(n-propanoyl)-2(1H)-pyridinone
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- Inchi： 1S/C9H11NO2/c1-3-8(11)7-4-5-9(12)10-6(7)2/h4-5H,3H2,1-2H3,(H,10,12)
- InChI Key： GWCNLYWJTUWLAR-UHFFFAOYSA-N
- SMILES： O=C(CC)C1C=CC(NC=1C)=O
Computed Properties
- Exact Mass: 165.078978594g/mol
- Monoisotopic Mass: 165.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 287
- 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: 0.5
- Topological Polar Surface Area: 46.2?2
2(1H)-Pyridinone, 6-methyl-5-(1-oxopropyl)- Related Literature
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Shivani Sharma,Chia-Ming Wu,Ranjit T. Koodali,N. Rajesh RSC Adv., 2016,6, 26668-26678
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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