Cas no 61893-03-6 (3-Pyridinol, 4-propyl-)
3-Pyridinol, 4-propyl- structure
Product Name:3-Pyridinol, 4-propyl-
CAS No:61893-03-6
MF:C8H11NO
MW:137.179042100906
CID:463607
Update Time:2024-01-30
3-Pyridinol, 4-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinol, 4-propyl-
-
- Inchi： 1S/C8H11NO/c1-2-3-7-4-5-9-6-8(7)10/h4-6,10H,2-3H2,1H3
- InChI Key： UKSAKFOVGJWPEB-UHFFFAOYSA-N
- SMILES： C1=NC=CC(CCC)=C1O
Computed Properties
- Exact Mass: 137.08413
- Monoisotopic Mass: 137.084
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 95.3
- 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
- Topological Polar Surface Area: 33.1A^2
Experimental Properties
- PSA: 33.12
- LogP: 1.73970
3-Pyridinol, 4-propyl- Related Literature
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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