Cas no 144425-08-1 (Pyrrolidine,1-methyl-2-(9-phenylnonyl)-, (2R)-)
144425-08-1 structure
Product Name:Pyrrolidine,1-methyl-2-(9-phenylnonyl)-, (2R)-
CAS No:144425-08-1
MF:C20H33N
MW:287.482725858688
CID:233551
Update Time:2024-03-01
Pyrrolidine,1-methyl-2-(9-phenylnonyl)-, (2R)- Chemical and Physical Properties
Names and Identifiers
-
- Pyrrolidine,1-methyl-2-(9-phenylnonyl)-, (2R)-
- (-)-Irniine
- Irniine
- Pyrrolidine,1-methyl-2-(9-phenylnonyl)-, (R)-
- Pyrrolidine, 1-methyl-2-(9-phenylnonyl)-, (2R)-
-
- Inchi： 1S/C20H33N/c1-21-18-12-17-20(21)16-11-6-4-2-3-5-8-13-19-14-9-7-10-15-19/h7,9-10,14-15,20H,2-6,8,11-13,16-18H2,1H3/t20-/m1/s1
- InChI Key： MNVHQKNDNJJRIX-HXUWFJFHSA-N
- SMILES： N1(C)CCC[C@H]1CCCCCCCCCC1=CC=CC=C1
Computed Properties
- Exact Mass: 287.26149
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 21
- XLogP3: 6.83
Experimental Properties
- Density: 0.916±0.06 g/cm3(Predicted)
- Boiling Point: 380.6±11.0 °C(Predicted)
- PSA: 3.24
- pka: 10.58±0.40(Predicted)
Pyrrolidine,1-methyl-2-(9-phenylnonyl)-, (2R)- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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