Cas no 1020037-97-1 (1-(2-Methylpyridin-4-yl)butane-1,3-dione)
1020037-97-1 structure
Product Name:1-(2-Methylpyridin-4-yl)butane-1,3-dione
CAS No:1020037-97-1
MF:C10H11NO2
MW:177.199842691422
CID:2623239
PubChem ID:53485441
Update Time:2025-04-21
1-(2-Methylpyridin-4-yl)butane-1,3-dione Chemical and Physical Properties
Names and Identifiers
-
- 1-(2-Methyl-4-pyridinyl)-1,3-butanedione
- DB-083206
- 1020037-97-1
- DTXSID10704603
- AKOS006303064
- 1-(2-Methylpyridin-4-yl)butane-1,3-dione
-
- Inchi： 1S/C10H11NO2/c1-7-5-9(3-4-11-7)10(13)6-8(2)12/h3-5H,6H2,1-2H3
- InChI Key： ARJOMGAZINYXPV-UHFFFAOYSA-N
- SMILES： O=C(CC(C)=O)C1C=CN=C(C)C=1
Computed Properties
- Exact Mass: 177.078979g/mol
- Monoisotopic Mass: 177.078979g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 213
- 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
- Molecular Weight: 177.2g/mol
- XLogP3: 0.8
- Topological Polar Surface Area: 47?2
1-(2-Methylpyridin-4-yl)butane-1,3-dione Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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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
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
1020037-97-1 (1-(2-Methylpyridin-4-yl)butane-1,3-dione) Related Products
- 475-71-8(Flavanthrone)
- 91-02-1(2-benzoylpyridine)
- 54-36-4(Metyrapone)
- 120-46-7(Dibenzoylmethane)
- 108-47-4(2,4-Lutidine)
- 104-90-5(5-Ethyl-2-methylpyridine)
- 108-75-8(2,4,6-Trimethylpyridine)
- 399-06-4(4,4,4-Trifluoro-1-(pyridin-4-yl)butane-1,3-dione)
- 350-03-8(1-(pyridin-3-yl)ethan-1-one)
- 101-82-6(2-Benzylpyridine)
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