Cas no 51238-63-2 (Cyclododecene, 1-methoxy-, (E)-)
51238-63-2 structure
Product Name:Cyclododecene, 1-methoxy-, (E)-
CAS No:51238-63-2
MF:C13H24O
MW:196.329064369202
CID:362758
PubChem ID:5463037
Update Time:2025-04-19
Cyclododecene, 1-methoxy-, (E)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclododecene, 1-methoxy-, (E)-
- 1-methoxycyclododecene
- SCHEMBL6161857
- (1E)-1-methoxycyclododec-1-ene
- AKOS006318782
- DTXSID601025376
- trans-1-Methoxycyclododecene
- 51238-63-2
- 1-Methoxy-cyclododecene
-
- Inchi： 1S/C13H24O/c1-14-13-11-9-7-5-3-2-4-6-8-10-12-13/h11H,2-10,12H2,1H3/b13-11+
- InChI Key： QKXCGPJJHMULFJ-ACCUITESSA-N
- SMILES： O(C)C1=CCCCCCCCCCC1 |t:2|
Computed Properties
- Exact Mass: 196.18282
- Monoisotopic Mass: 196.182715385g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 161
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.2
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Cyclododecene, 1-methoxy-, (E)- Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
-
Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
-
4. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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