Cas no 68310-64-5 (4-[2-[(2-hydroxypropyl)amino]ethyl]-alpha-methylpiperazine-1-ethanol)
68310-64-5 structure
Product Name:4-[2-[(2-hydroxypropyl)amino]ethyl]-alpha-methylpiperazine-1-ethanol
CAS No:68310-64-5
MF:C12H27N3O2
MW:245.361683130264
CID:970021
PubChem ID:109298
Update Time:2025-04-19
4-[2-[(2-hydroxypropyl)amino]ethyl]-alpha-methylpiperazine-1-ethanol Chemical and Physical Properties
Names and Identifiers
-
- 4-[2-[(2-hydroxypropyl)amino]ethyl]-alpha-methylpiperazine-1-ethanol
- 1-(4-{2-[(2-hydroxypropyl)amino]ethyl}piperazin-1-yl)propan-2-ol
- 1-Piperazineethanol, 4-(2-((2-hydroxypropyl)amino)ethyl)-alpha-methyl-
- 4-(2-((2-Hydroxypropyl)amino)ethyl)-alpha-methylpiperazine-1-ethanol
- N-(2-Hydroxypropyl)-N'-(2-(2-hydroxypropyl)aminoethyl)piperazine
- 1-Piperazineethanol, 4-[2-[(2-hydroxypropyl)amino]ethyl]-.alpha.-methyl-
- NS00059790
- EINECS 269-723-9
- 68310-64-5
- DTXSID60887334
- XANQSUUVEHXZHA-UHFFFAOYSA-N
-
- Inchi: 1S/C12H27N3O2/c1-11(16)9-13-3-4-14-5-7-15(8-6-14)10-12(2)17/h11-13,16-17H,3-10H2,1-2H3
- InChI Key: XANQSUUVEHXZHA-UHFFFAOYSA-N
- SMILES: OC(C)CN1CCN(CCNCC(C)O)CC1
Computed Properties
- Exact Mass: 245.21032711g/mol
- Monoisotopic Mass: 245.21032711g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 7
- Complexity: 196
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.9
- Topological Polar Surface Area: 59?2
4-[2-[(2-hydroxypropyl)amino]ethyl]-alpha-methylpiperazine-1-ethanol Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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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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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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