Cas no 130688-21-0 (Piperidine,1-[2-[tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl]ethyl]-)
130688-21-0 structure
Product Name:Piperidine,1-[2-[tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl]ethyl]-
CAS No:130688-21-0
MF:C21H33NO
MW:315.492826223373
CID:143482
PubChem ID:3076287
Update Time:2025-04-19
Piperidine,1-[2-[tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl]ethyl]- Chemical and Physical Properties
Names and Identifiers
-
- Piperidine,1-[2-[tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl]ethyl]-
- 1-[2-(4-benzyl-2,2-dimethyloxan-4-yl)ethyl]piperidine
- DTXSID00926852
- Oprea1_515967
- 1-(2-(Tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl)ethyl)piperidine
- Oprea1_527703
- 130688-21-0
- Piperidine, 1-(2-(tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl)ethyl)-
- BRN 4355255
-
- Inchi: 1S/C21H33NO/c1-20(2)18-21(12-16-23-20,17-19-9-5-3-6-10-19)11-15-22-13-7-4-8-14-22/h3,5-6,9-10H,4,7-8,11-18H2,1-2H3
- InChI Key: CFYZQFZUHMFACC-UHFFFAOYSA-N
- SMILES: O1CCC(CC2C=CC=CC=2)(CCN2CCCCC2)CC1(C)C
Computed Properties
- Exact Mass: 315.25639
- Monoisotopic Mass: 315.256
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 23
- Rotatable Bond Count: 5
- Complexity: 355
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.5
- Topological Polar Surface Area: 12.5?2
Experimental Properties
- Density: 0.974
- Boiling Point: 409.6°C at 760 mmHg
- Flash Point: 120.3°C
- Refractive Index: 1.511
- PSA: 12.47
Piperidine,1-[2-[tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl]ethyl]- Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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