56797-40-1 Purity
96%
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Specification
The molecular formula of Z-13-Octadecenyl acetate is C20H38O2.
The molecular weight of Z-13-Octadecenyl acetate is 310.5 g/mol.
The IUPAC name of Z-13-Octadecenyl acetate is [(Z)-octadec-13-enyl] acetate.
The InChIKey of Z-13-Octadecenyl acetate is PPNRRQMJESAXGJ-SREVYHEPSA-N.
The canonical SMILES of Z-13-Octadecenyl acetate is CCCCC=CCCCCCCCCCCCCOC(=O)C.
The CAS number of Z-13-Octadecenyl acetate is 60037-58-3.
The XLogP3-AA value of Z-13-Octadecenyl acetate is 8.
Z-13-Octadecenyl acetate has 0 hydrogen bond donor counts.
Z-13-Octadecenyl acetate has 2 hydrogen bond acceptor counts.
Z-13-Octadecenyl acetate has 17 rotatable bond counts.
Reference: [1]Subbaraman, A S; Mithran, S; Mamdapur, V R
[Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1991, vol. 30, # 9, p. 865 - 866]
[2]Kim, Sang Sook; Hong, Yong Pyo
[Bulletin of the Korean Chemical Society, 2011, vol. 32, p. 3120 - 3122]
[3]Trehan; Vig; Singh; Sharma; Kad
[Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1990, vol. 29, # 6, p. 518 - 520]
Reference: [1]Subbaraman, A S; Mithran, S; Mamdapur, V R
[Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1991, vol. 30, # 9, p. 865 - 866]
Reference: [1]Subbaraman, A S; Mithran, S; Mamdapur, V R
[Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1991, vol. 30, # 9, p. 865 - 866]