Cas no 1404367-47-0 (3-bromo-5-(1-vinylcyclopropyl)pyridine)
1404367-47-0 structure
Product Name:3-bromo-5-(1-vinylcyclopropyl)pyridine
CAS No:1404367-47-0
MF:C10H10BrN
MW:224.097101688385
CID:2122978
Update Time:2023-11-19
3-bromo-5-(1-vinylcyclopropyl)pyridine Chemical and Physical Properties
Names and Identifiers
-
- 3-bromo-5-(1-vinylcyclopropyl)pyridine
- QVHVPZBJMAGQCE-UHFFFAOYSA-N
- 3-bromo-5-(1-ethenylcyclopropyl)pyridine
- CID 89155903
- Pyridine, 3-bromo-5-(1-ethenylcyclopropyl)-
-
- Inchi： 1S/C10H10BrN/c1-2-10(3-4-10)8-5-9(11)7-12-6-8/h2,5-7H,1,3-4H2
- InChI Key： QVHVPZBJMAGQCE-UHFFFAOYSA-N
- SMILES： BrC1=CN=CC(=C1)C1(C=C)CC1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 186
- Topological Polar Surface Area: 12.9
Experimental Properties
- Density: 1.533±0.06 g/cm3(Predicted)
- Boiling Point: 266.1±35.0 °C(Predicted)
- pka: 3.17±0.22(Predicted)
3-bromo-5-(1-vinylcyclopropyl)pyridine Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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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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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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