Cas no 618067-93-9 (Cyclododecane, 1,1-dimethoxy-2-nonyl-)
618067-93-9 structure
Product Name:Cyclododecane, 1,1-dimethoxy-2-nonyl-
CAS No:618067-93-9
MF:C23H46O2
MW:354.610147953033
CID:465626
PubChem ID:71391968
Update Time:2025-04-19
Cyclododecane, 1,1-dimethoxy-2-nonyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclododecane, 1,1-dimethoxy-2-nonyl-
- 1,1-dimethoxy-2-nonylcyclododecane
- DTXSID20813790
- 618067-93-9
-
- Inchi： 1S/C23H46O2/c1-4-5-6-7-10-13-16-19-22-20-17-14-11-8-9-12-15-18-21-23(22,24-2)25-3/h22H,4-21H2,1-3H3
- InChI Key： VFSFSUOKMFLDLV-UHFFFAOYSA-N
- SMILES： O(C)C1(CCCCCCCCCCC1CCCCCCCCC)OC
Computed Properties
- Exact Mass: 354.34998
- Monoisotopic Mass: 354.349780706g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 25
- Rotatable Bond Count: 10
- Complexity: 286
- 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: 9.5
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- PSA: 18.46
Cyclododecane, 1,1-dimethoxy-2-nonyl- Related Literature
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Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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