Cas no 58930-03-3 (Amyl Elaidate)
Amyl Elaidate structure
Product Name:Amyl Elaidate
CAS No:58930-03-3
MF:C23H44O2
MW:352.594267845154
CID:1611459
PubChem ID:5462694
Update Time:2025-04-21
Amyl Elaidate Chemical and Physical Properties
Names and Identifiers
-
- Amyl Elaidate
- CTK1J0533
- 9-Octadecynoyl chloride
- Octadec-9-inoylchlorid
- Stearolsaeurechlorid
- Octadec-9t-ensaeure-pentylester
- AGN-PC-00MW88
- pentylelaidate
- CTK1J0533; 9-Octadecynoyl chloride; Octadec-9-inoylchlorid; Stearolsaeurechlorid; Octadec-9t-ensaeure-pentylester; AGN-PC-00MW88; pentylelaidate;
- 58930-03-3
- trans-9-Octadecenoic acid, pentyl ester
- SCHEMBL506534
- SCHEMBL3658738
- NSC 152071
- YEUKJHYLBPPSQJ-OUKQBFOZSA-N
- 9-Octadecenoic acid, pentyl ester
- (E)-9-Octadecenoic acid pentyl ester
-
- Inchi： 1S/C23H44O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23(24)25-22-20-6-4-2/h12-13H,3-11,14-22H2,1-2H3/b13-12+
- InChI Key： YEUKJHYLBPPSQJ-OUKQBFOZSA-N
- SMILES： O(CCCCC)C(CCCCCCC/C=C/CCCCCCCC)=O
Computed Properties
- Exact Mass: 352.33432
- Monoisotopic Mass: 352.334130642g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 25
- Rotatable Bond Count: 20
- Complexity: 297
- 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: 9.4
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
- LogP: 7.75730
Amyl Elaidate Related Literature
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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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
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
-
Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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