Cas no 61515-77-3 (1-Piperidineheptanol, 4-hexyl-, hydrochloride)
61515-77-3 structure
Product Name:1-Piperidineheptanol, 4-hexyl-, hydrochloride
CAS No:61515-77-3
MF:C18H38ClNO
MW:319.953424930573
CID:476599
PubChem ID:71395063
Update Time:2025-04-19
1-Piperidineheptanol, 4-hexyl-, hydrochloride Chemical and Physical Properties
Names and Identifiers
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- 1-Piperidineheptanol, 4-hexyl-, hydrochloride
- 7-(4-hexylpiperidin-1-yl)heptan-1-ol,hydrochloride
- 7-(4-Hexylpiperidin-1-yl)heptan-1-ol--hydrogen chloride (1/1)
- 61515-77-3
- DTXSID80816722
-
- Inchi： 1S/C18H37NO.ClH/c1-2-3-4-8-11-18-12-15-19(16-13-18)14-9-6-5-7-10-17-20;/h18,20H,2-17H2,1H3;1H
- InChI Key： QILMSOSLPLSGGB-UHFFFAOYSA-N
- SMILES： Cl.OCCCCCCCN1CCC(CCCCCC)CC1
Computed Properties
- Exact Mass: 319.26444
- Monoisotopic Mass: 319.2641925g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 12
- Complexity: 200
- 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-Piperidineheptanol, 4-hexyl-, hydrochloride Related Literature
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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