Cas no 677761-67-0 (3-Hydroxydecanoic acid; (R)-form, 3-O-(3R-Hydroxydecanoyl))
677761-67-0 structure
Product Name:3-Hydroxydecanoic acid; (R)-form, 3-O-(3R-Hydroxydecanoyl)
CAS No:677761-67-0
MF:C20H38O5
MW:358.51272726059
CID:2851233
PubChem ID:71367693
Update Time:2025-04-21
3-Hydroxydecanoic acid; (R)-form, 3-O-(3R-Hydroxydecanoyl) Chemical and Physical Properties
Names and Identifiers
-
- r-3-(r-3-hydroxydecanoyl)oxydecanoic acid
- (3R)-3-{[(3R)-3-Hydroxydecanoyl]oxy}decanoic acid
- DTXSID70790805
- CHEBI:139110
- 677761-67-0
- (3R,7R)-3-Heptyl-5-oxo-7-hydroxy-4-oxatetradecanoic acid
- (r,r)-3-(3-hydroxydecanoyloxy)decanoic acid
- 3-Hydroxydecanoic acid; (R)-form, 3-O-(3R-Hydroxydecanoyl)
-
- Inchi： 1S/C20H38O5/c1-3-5-7-9-11-13-17(21)15-20(24)25-18(16-19(22)23)14-12-10-8-6-4-2/h17-18,21H,3-16H2,1-2H3,(H,22,23)
- InChI Key： ZFPAFAWFRTWCSK-UHFFFAOYSA-N
- SMILES： CCCCCCCC(CC(OC(CC(=O)O)CCCCCCC)=O)O
Computed Properties
- Exact Mass: 358.27192431Da
- Monoisotopic Mass: 358.27192431Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 25
- Rotatable Bond Count: 18
- Complexity: 343
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.8
- Topological Polar Surface Area: 83.8?2
3-Hydroxydecanoic acid; (R)-form, 3-O-(3R-Hydroxydecanoyl) Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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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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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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