Cas no 22202-42-2 (1,2-di-(9Z-octadecenoyl)glycerol)
22202-42-2 structure
Product Name:1,2-di-(9Z-octadecenoyl)glycerol
CAS No:22202-42-2
MF:C39H72O5
MW:620.985993385315
CID:2030676
PubChem ID:97041703
Update Time:2025-04-21
1,2-di-(9Z-octadecenoyl)glycerol Chemical and Physical Properties
Names and Identifiers
-
- 1,2-di-(9Z-octadecenoyl)glycerol
- 1,2-dioleoyl glycerol ester
- 1,2-Dioleoyl-rac-glycerol
- 3-hydroxy-1,2-propanediyl dioleate
- 9-Octadecenoic acid (Z)-, 1-(hydroxymethyl)-1,2-ethanediyl ester
- cis-1,2-dioleoyl-rac-glycerol
- glycerol dioleate
- DTXSID20274302
- Elaidin, 1,a2-adi-a, L-
- 22202-42-2
-
- Inchi： 1S/C39H72O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,37,40H,3-16,21-36H2,1-2H3/b19-17+,20-18+/t37-/m1/s1
- InChI Key： AFSHUZFNMVJNKX-QTPQSBHWSA-N
- SMILES： O([C@H](CO)COC(CCCCCCC/C=C/CCCCCCCC)=O)C(CCCCCCC/C=C/CCCCCCCC)=O
Computed Properties
- Exact Mass: 620.53797539g/mol
- Monoisotopic Mass: 620.53797539g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 44
- Rotatable Bond Count: 36
- Complexity: 671
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- XLogP3: 14.3
- Topological Polar Surface Area: 72.8?2
1,2-di-(9Z-octadecenoyl)glycerol Related Literature
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Mei-Yu Xu,Ya-Ting Wang,Qing-Ling Ni,Zi-Hao Zhang,Guang-Ming Liang,Liu-Cheng Gui Dalton Trans., 2016,45, 4993-4997
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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