Cas no 2379797-58-5 (Stigmast-5-en-3-ol, 3-nonadecanoate, (3β)-)
2379797-58-5 structure
Product Name:Stigmast-5-en-3-ol, 3-nonadecanoate, (3β)-
CAS No:2379797-58-5
MF:C48H86O2
MW:695.195255756378
CID:5108184
Update Time:2023-08-23
Stigmast-5-en-3-ol, 3-nonadecanoate, (3β)- Chemical and Physical Properties
Names and Identifiers
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- Stigmast-5-en-3-ol, 3-nonadecanoate, (3β)-
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- Inchi： 1S/C48H86O2/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-46(49)50-41-32-34-47(6)40(36-41)28-29-42-44-31-30-43(48(44,7)35-33-45(42)47)38(5)26-27-39(9-2)37(3)4/h28,37-39,41-45H,8-27,29-36H2,1-7H3/t38-,39-,41+,42+,43-,44+,45+,47+,48-/m1/s1
- InChI Key： ZJQZVYMBQRKNEL-WQFSEJNKSA-N
- SMILES： [C@@H]1(OC(=O)CCCCCCCCCCCCCCCCCC)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CC[C@H](C(C)C)CC)CC3)CC=2
Experimental Properties
- Density: 0.94±0.1 g/cm3(Predicted)
- Boiling Point: 698.7±34.0 °C(Predicted)
Stigmast-5-en-3-ol, 3-nonadecanoate, (3β)- Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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