Cas no 61515-66-0 (1-Piperidinepentanol, 4-hexyl-, hydrochloride)
61515-66-0 structure
Product Name:1-Piperidinepentanol, 4-hexyl-, hydrochloride
CAS No:61515-66-0
MF:C16H34ClNO
MW:291.900264263153
CID:476610
PubChem ID:23328916
Update Time:2025-04-19
1-Piperidinepentanol, 4-hexyl-, hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- 1-Piperidinepentanol, 4-hexyl-, hydrochloride
- 5-(4-hexylpiperidin-1-yl)pentan-1-ol,hydrochloride
- SCHEMBL11489213
- 61515-66-0
- DTXSID80632964
- CTTFFXANBZQFDI-UHFFFAOYSA-N
- 5-(4-Hexylpiperidin-1-yl)pentan-1-ol--hydrogen chloride (1/1)
- 4-n-hexyl-1-(5-hydroxypentyl)piperidine hydrochloride
-
- Inchi： 1S/C16H33NO.ClH/c1-2-3-4-6-9-16-10-13-17(14-11-16)12-7-5-8-15-18;/h16,18H,2-15H2,1H3;1H
- InChI Key： CTTFFXANBZQFDI-UHFFFAOYSA-N
- SMILES： Cl.OCCCCCN1CCC(CCCCCC)CC1
Computed Properties
- Exact Mass: 291.23312
- Monoisotopic Mass: 291.2328924g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 10
- Complexity: 176
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 23.5?2
Experimental Properties
- PSA: 23.47
1-Piperidinepentanol, 4-hexyl-, hydrochloride Related Literature
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Masrudin Md Yusoff,Muggundha Raoov,Noorfatimah Yahaya,Noorashikin Md Salleh RSC Adv., 2017,7, 35832-35844
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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