Cas no 61780-17-4 (Methanone, (4-butylphenyl)-4-pyridinyl-)
61780-17-4 structure
Product Name:Methanone, (4-butylphenyl)-4-pyridinyl-
CAS No:61780-17-4
MF:C16H17NO
MW:239.312284231186
CID:466413
PubChem ID:43160110
Update Time:2025-04-19
Methanone, (4-butylphenyl)-4-pyridinyl- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, (4-butylphenyl)-4-pyridinyl-
- (4-butylphenyl)-pyridin-4-ylmethanone
- (4-Butylphenyl)(pyridin-4-yl)methanone
- DTXSID80655613
- 61780-17-4
-
- Inchi： 1S/C16H17NO/c1-2-3-4-13-5-7-14(8-6-13)16(18)15-9-11-17-12-10-15/h5-12H,2-4H2,1H3
- InChI Key： BYYWYYYBYQJAGW-UHFFFAOYSA-N
- SMILES： O=C(C1C=CN=CC=1)C1C=CC(=CC=1)CCCC
Computed Properties
- Exact Mass: 239.13111
- Monoisotopic Mass: 239.131014166g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 250
- 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: 4
- Topological Polar Surface Area: 30?2
Experimental Properties
- PSA: 29.96
Methanone, (4-butylphenyl)-4-pyridinyl- Related Literature
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
61780-17-4 (Methanone, (4-butylphenyl)-4-pyridinyl-) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
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