Cas no 61382-77-2 (Cyclohexene, 1-(pentyloxy)-)
Cyclohexene, 1-(pentyloxy)- structure
Product Name:Cyclohexene, 1-(pentyloxy)-
CAS No:61382-77-2
MF:C11H20O
MW:168.275903701782
CID:481435
PubChem ID:70636801
Update Time:2025-04-19
Cyclohexene, 1-(pentyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexene, 1-(pentyloxy)-
- 1-pentoxycyclohexene
- 61382-77-2
- SCHEMBL11699138
- DTXSID40742573
- 1-(pentyloxy)cyclohex-1-ene
-
- Inchi： 1S/C11H20O/c1-2-3-7-10-12-11-8-5-4-6-9-11/h8H,2-7,9-10H2,1H3
- InChI Key： NULVUQQEOZNQNB-UHFFFAOYSA-N
- SMILES： O(CCCCC)C1=CCCCC1
Computed Properties
- Exact Mass: 168.1515
- Monoisotopic Mass: 168.151415257g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 5
- Complexity: 138
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.8
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Cyclohexene, 1-(pentyloxy)- Related Literature
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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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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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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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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
61382-77-2 (Cyclohexene, 1-(pentyloxy)-) Related Products
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- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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