Cas no 23336-49-4 (Heptanoic acid,1,1'-[2-methyl-2-[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester)
![Heptanoic acid,1,1'-[2-methyl-2-[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester structure](https://ossimg.kuujia.com/scimg/23500/23336-49-4x500.png)
23336-49-4 structure
Product Name:Heptanoic acid,1,1'-[2-methyl-2-[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester
CAS No:23336-49-4
MF:C26H48O6
MW:456.655729293823
CID:280237
PubChem ID:90069
Update Time:2025-04-19
Heptanoic acid,1,1'-[2-methyl-2-[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester Chemical and Physical Properties
Names and Identifiers
-
- Heptanoic acid,1,1'-[2-methyl-2-[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester
- 3-(Heptanoyloxy)-2-[(heptanoyloxy)methyl]-2-methylpropyl heptanoate
- heptanoic acid, 2-methyl-3-[(1-oxoheptyl)oxy]-2-[[(1-oxoheptyl)oxy]methyl]propyl ester
- 23336-49-4
- Heptanoic acid, 2-methyl-2-(((1-oxoheptyl)oxy)methyl)-1,3-propanediyl ester
- 2-[(Heptanoyloxy)methyl]-2-methylpropane-1,3-diyl diheptanoate
- Heptanoic acid, 1,1'-(2-methyl-2-(((1-oxoheptyl)oxy)methyl)-1,3-propanediyl) ester
- Trimethylolethane triheptanoate
- DTXSID10946001
-
- Inchi： 1S/C26H48O6/c1-5-8-11-14-17-23(27)30-20-26(4,21-31-24(28)18-15-12-9-6-2)22-32-25(29)19-16-13-10-7-3/h5-22H2,1-4H3
- InChI Key： ZMAZJSDJZUMVHX-UHFFFAOYSA-N
- SMILES： O(C(CCCCCC)=O)CC(C)(COC(CCCCCC)=O)COC(CCCCCC)=O
Computed Properties
- Exact Mass: 456.34524
- Monoisotopic Mass: 456.34508925g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 32
- Rotatable Bond Count: 24
- Complexity: 433
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 7.9
- Topological Polar Surface Area: 78.9?2
Experimental Properties
- PSA: 78.9
Heptanoic acid,1,1'-[2-methyl-2-[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester Related Literature
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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4. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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M. A. Piechowiak,A. Videcoq,R. Ferrando,D. Bochicchio,C. Pagnoux,F. Rossignol Phys. Chem. Chem. Phys., 2012,14, 1431-1439
23336-49-4 (Heptanoic acid,1,1'-[2-methyl-2-[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester) Related Products
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