Cas no 101997-57-3 (1-Piperidineethanamine,N,N-bis(cyclohexylmethyl)-, hydrochloride (1:2))
101997-57-3 structure
Product Name:1-Piperidineethanamine,N,N-bis(cyclohexylmethyl)-, hydrochloride (1:2)
CAS No:101997-57-3
MF:C21H42Cl2N2
MW:393.47758436203
CID:196500
PubChem ID:3064208
Update Time:2025-04-19
1-Piperidineethanamine,N,N-bis(cyclohexylmethyl)-, hydrochloride (1:2) Chemical and Physical Properties
Names and Identifiers
-
- 1-Piperidineethanamine,N,N-bis(cyclohexylmethyl)-, hydrochloride (1:2)
- N,N-bis(cyclohexylmethyl)-2-piperidin-1-ylethanamine,dihydrochloride
- 101997-57-3
- DTXSID50144504
- Piperidine, 1-(2-(bis(cyclohexylmethyl)amino)ethyl)-, dihydrochloride
- 1-(2-(Bis(cyclohexylmethyl)amino)ethyl)piperidine dihydrochloride
-
- Inchi： 1S/C21H40N2.2ClH/c1-4-10-20(11-5-1)18-23(19-21-12-6-2-7-13-21)17-16-22-14-8-3-9-15-22;;/h20-21H,1-19H2;2*1H
- InChI Key： DGGCHOIJZBAYIA-UHFFFAOYSA-N
- SMILES： Cl.Cl.N(CCN1CCCCC1)(CC1CCCCC1)CC1CCCCC1
Computed Properties
- Exact Mass: 392.27286
- Monoisotopic Mass: 392.273
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 25
- Rotatable Bond Count: 7
- Complexity: 279
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 6.5?2
Experimental Properties
- Boiling Point: 354°Cat760mmHg
- Flash Point: 148.4°C
- PSA: 6.48
- LogP: 6.47680
1-Piperidineethanamine,N,N-bis(cyclohexylmethyl)-, hydrochloride (1:2) Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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