Cas no 56645-05-7 (Sunsoft 47S)
Sunsoft 47S structure
Product Name:Sunsoft 47S
CAS No:56645-05-7
MF:C20H38O6
MW:374.512127399445
CID:372688
PubChem ID:6453369
Update Time:2025-04-19
Sunsoft 47S Chemical and Physical Properties
Names and Identifiers
-
- Sunsoft 47S
- (4xi)-1,4-anhydro-5-O-tetradecanoyl-D-xylo-hexitol
- Sorbitan, tetradecanoate
- 63059-79-0
- 1,4-Anhydro-5-O-tetradecanoylhexitol
- NS00122828
- 56645-05-7
- DTXSID40972090
- EINECS 260-306-7
- EINECS 263-834-6
- Sorbitan, monotetradecanoate
-
- Inchi: 1S/C20H38O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-18(23)26-17(14-21)20-19(24)16(22)15-25-20/h16-17,19-22,24H,2-15H2,1H3/t16-,17+,19+,20?/m0/s1
- InChI Key: KHCJXZZSXZAYPX-RDNNMJBUSA-N
- SMILES: O1C[C@@H]([C@H](C1[C@@H](CO)OC(CCCCCCCCCCCCC)=O)O)O
Computed Properties
- Exact Mass: 374.26683893g/mol
- Monoisotopic Mass: 374.26683893g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 26
- Rotatable Bond Count: 16
- Complexity: 362
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.2
- Topological Polar Surface Area: 96.2?2
Sunsoft 47S Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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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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