Cas no 61272-37-5 (Piperazine, 1-(2-chloroethyl)-4-ethyl-)
61272-37-5 structure
Product Name:Piperazine, 1-(2-chloroethyl)-4-ethyl-
CAS No:61272-37-5
MF:C8H17ClN2
MW:176.686980962753
CID:486290
PubChem ID:410963
Update Time:2025-04-19
Piperazine, 1-(2-chloroethyl)-4-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- Piperazine, 1-(2-chloroethyl)-4-ethyl-
- 1-(2-chloroethyl)-4-ethylpiperazine
- 61272-37-5
- AKOS010540097
- DTXSID50328509
- SCHEMBL3441890
-
- Inchi： 1S/C8H17ClN2/c1-2-10-5-7-11(4-3-9)8-6-10/h2-8H2,1H3
- InChI Key： GEHDHIQFHOTWAU-UHFFFAOYSA-N
- SMILES： ClCCN1CCN(CC)CC1
Computed Properties
- Exact Mass: 176.10821
- Monoisotopic Mass: 176.108
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 100
- 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
- XLogP3: 1
- Topological Polar Surface Area: 6.5?2
Experimental Properties
- PSA: 6.48
Piperazine, 1-(2-chloroethyl)-4-ethyl- Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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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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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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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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