Cas no 100054-24-8 (Pyridine,5-ethyl-2-methyl-4-(1-methylethyl)-)
100054-24-8 structure
Product Name:Pyridine,5-ethyl-2-methyl-4-(1-methylethyl)-
CAS No:100054-24-8
MF:C11H17N
MW:163.259382963181
CID:123921
Update Time:2022-09-23
Pyridine,5-ethyl-2-methyl-4-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
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- Pyridine,5-ethyl-2-methyl-4-(1-methylethyl)-
- 2-Picoline,5-ethyl-4-isopropyl-(6CI)
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- Inchi： 1S/C11H17N/c1-5-10-7-12-9(4)6-11(10)8(2)3/h6-8H,5H2,1-4H3
- InChI Key： IGQRUHNAKALMHY-UHFFFAOYSA-N
- SMILES： C1(C)=NC=C(CC)C(C(C)C)=C1
Computed Properties
- Exact Mass: 163.1361g/mol
- Monoisotopic Mass: 163.1361g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 131
- 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: 163.26g/mol
- XLogP3: 3.2
- Topological Polar Surface Area: 12.9?2
Pyridine,5-ethyl-2-methyl-4-(1-methylethyl)- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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