Cas no 54794-70-6 (2,4-Octadecadienamide, N-(2-methylpropyl)-, (E,E)-)
54794-70-6 structure
Product Name:2,4-Octadecadienamide, N-(2-methylpropyl)-, (E,E)-
CAS No:54794-70-6
MF:C22H41NO
MW:335.567046880722
CID:353660
PubChem ID:9974234
Update Time:2025-04-19
2,4-Octadecadienamide, N-(2-methylpropyl)-, (E,E)- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Octadecadienamide, N-(2-methylpropyl)-, (E,E)-
- N-(2-methylpropyl)octadeca-2,4-dienamide
- (2E,4E)-N-Isobutyloctadeca-2,4-dienamide
- (2E,4E)-N-(2-methylpropyl)octadeca-2,4-dienamide
- QQCGKIZHTJLRNN-NBRVCOCJSA-N
- 2,4-Octadecadienamide, N-(2-methylpropyl)-, (2E,4E)-
- Pipericine
- CHEMBL256217
- LMFA08020200
- DTXSID10718144
- N-isobutyl-(2E,4E)-octadecadienamide
- (E,E)-N-Isobutyl-2,4-octadecadienamide
- (2E,4Z)-N-(2-METHYLPROPYL)OCTADECA-2,4-DIENAMIDE
- CHEBI:165576
- N-Isobutyl-(2E,4E)-octadeca-2,4-dienamide
- N-Isobutyloctadeca-trans-2-trans-4-dienamide
- 54794-70-6
-
- Inchi： 1S/C22H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(24)23-20-21(2)3/h16-19,21H,4-15,20H2,1-3H3,(H,23,24)/b17-16+,19-18+
- InChI Key： QQCGKIZHTJLRNN-NBRVCOCJSA-N
- SMILES： O=C(/C=C/C=C/CCCCCCCCCCCCC)NCC(C)C
Computed Properties
- Exact Mass: 335.31903
- Monoisotopic Mass: 335.318814931g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 24
- Rotatable Bond Count: 16
- Complexity: 331
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- XLogP3: 8.7
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
2,4-Octadecadienamide, N-(2-methylpropyl)-, (E,E)- Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
54794-70-6 (2,4-Octadecadienamide, N-(2-methylpropyl)-, (E,E)-) Related Products
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