Cas no 78418-64-1 (12-Methyl-oxa-cyclododec-6-en-2-one)
78418-64-1 structure
Product Name:12-Methyl-oxa-cyclododec-6-en-2-one
CAS No:78418-64-1
MF:C12H20O2
MW:196.286004066467
CID:576826
Update Time:2024-03-01
12-Methyl-oxa-cyclododec-6-en-2-one Chemical and Physical Properties
Names and Identifiers
-
- Oxacyclododec-6-en-2-one,12-methyl-, (6Z)-
- Oxacyclododec-6-en-2-one,12-methyl-, (Z)-
- Phoracantholide M
- 12-Methyl-oxa-cyclododec-6-en-2-one
- LDWZVYJMOWTMFA-RQOWECAXSA-N
- LMFA07040041
-
- Inchi: 1S/C12H20O2/c1-11-9-7-5-3-2-4-6-8-10-12(13)14-11/h2,4,11H,3,5-10H2,1H3/b4-2-
- InChI Key: LDWZVYJMOWTMFA-RQOWECAXSA-N
- SMILES: O1C(CCCC=CCCCCC1C)=O |c:5|
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 197
- Topological Polar Surface Area: 26.3
12-Methyl-oxa-cyclododec-6-en-2-one Related Literature
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
-
Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
-
Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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