Cas no 109201-48-1 (Pyridine, 2-chloro-6-hexyl-)
Pyridine, 2-chloro-6-hexyl- structure
Product Name:Pyridine, 2-chloro-6-hexyl-
CAS No:109201-48-1
MF:C11H16ClN
MW:197.704442024231
CID:2868044
Update Time:2023-08-10
Pyridine, 2-chloro-6-hexyl- Chemical and Physical Properties
Names and Identifiers
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- Pyridine, 2-chloro-6-hexyl-
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- Inchi： 1S/C11H16ClN/c1-2-3-4-5-7-10-8-6-9-11(12)13-10/h6,8-9H,2-5,7H2,1H3
- InChI Key： HBUNMVLPQRWTMC-UHFFFAOYSA-N
- SMILES： ClC1=CC=CC(CCCCCC)=N1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 5
- Complexity: 127
- XLogP3: 4.6
- Topological Polar Surface Area: 12.9
Pyridine, 2-chloro-6-hexyl- Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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