Cas no 40465-44-9 (Pyrrolidine, 2,4-dimethyl-, cis-)
40465-44-9 structure
Product Name:Pyrrolidine, 2,4-dimethyl-, cis-
CAS No:40465-44-9
MF:C6H13N
MW:99.1741216182709
CID:2632690
PubChem ID:23279028
Update Time:2025-04-21
Pyrrolidine, 2,4-dimethyl-, cis- Chemical and Physical Properties
Names and Identifiers
-
- Pyrrolidine, 2,4-dimethyl-, (2R,4S)-rel-
- DTXSID60632447
- UNII-TGD36NJ2DG
- AKOS006359055
- Rel-(2R,4S)-2,4-dimethylpyrrolidine
- Pyrrolidine, 2,4-dimethyl-, cis-
- (2S,4R)-2,4-Dimethylpyrrolidine
- 2,4-Dimethylpyrrolidine, cis-
- TGD36NJ2DG
- 40465-44-9
- cis-2,4-dimethylpyrrolidine
-
- Inchi： 1S/C6H13N/c1-5-3-6(2)7-4-5/h5-7H,3-4H2,1-2H3/t5-,6+/m1/s1
- InChI Key： DUOJVRWFIHNZTJ-RITPCOANSA-N
- SMILES： N1C[C@H](C)C[C@@H]1C
Computed Properties
- Exact Mass: 99.104799419Da
- Monoisotopic Mass: 99.104799419Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 7
- Rotatable Bond Count: 0
- Complexity: 61.2
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.2
- Topological Polar Surface Area: 12?2
Pyrrolidine, 2,4-dimethyl-, cis- 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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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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