Cas no 3977-79-5 (1-(1-Butyl-4-piperidyl)-2-methyl-2-phenyl-1-indanol)
3977-79-5 structure
Product Name:1-(1-Butyl-4-piperidyl)-2-methyl-2-phenyl-1-indanol
CAS No:3977-79-5
MF:C25H33NO
MW:363.535627126694
CID:44644
PubChem ID:53400923
Update Time:2025-04-18
1-(1-Butyl-4-piperidyl)-2-methyl-2-phenyl-1-indanol Chemical and Physical Properties
Names and Identifiers
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- 1-(1-Butyl-4-piperidyl)-2-methyl-2-phenyl-1-indanol
- 1-(1-BUTYLPIPERIDIN-4-YL)-2-METHYL-2-PHENYL-3H-INDEN-1-OL
- 3977-79-5
- DTXSID70694718
- 1-(1-Butylpiperidin-4-yl)-2-methyl-2-phenyl-2,3-dihydro-1H-inden-1-ol
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- Inchi: 1S/C25H33NO/c1-3-4-16-26-17-14-22(15-18-26)25(27)23-13-9-8-10-20(23)19-24(25,2)21-11-6-5-7-12-21/h5-13,22,27H,3-4,14-19H2,1-2H3
- InChI Key: HAWOUMPDLOJSBV-UHFFFAOYSA-N
- SMILES: OC1(C2C=CC=CC=2CC1(C1C=CC=CC=1)C)C1CCN(CCCC)CC1
Computed Properties
- Exact Mass: 363.256
- Monoisotopic Mass: 363.256
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 27
- Rotatable Bond Count: 5
- Complexity: 479
- 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: 5.3
- Topological Polar Surface Area: 23.5?2
Experimental Properties
- Density: 1.074
- Flash Point: 8 oC
- PSA: 23.47000
- LogP: 4.83820
1-(1-Butyl-4-piperidyl)-2-methyl-2-phenyl-1-indanol Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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