Cas no 62266-62-0 (7-Oxabicyclo[4.1.0]heptane-3-carboxylic acid, pentadecyl ester)
![7-Oxabicyclo[4.1.0]heptane-3-carboxylic acid, pentadecyl ester structure](https://ossimg.kuujia.com/scimg/62500/62266-62-0x500.png)
62266-62-0 structure
Product Name:7-Oxabicyclo[4.1.0]heptane-3-carboxylic acid, pentadecyl ester
CAS No:62266-62-0
MF:C22H40O3
MW:352.551207542419
CID:451803
PubChem ID:71388124
Update Time:2025-04-19
7-Oxabicyclo[4.1.0]heptane-3-carboxylic acid, pentadecyl ester Chemical and Physical Properties
Names and Identifiers
-
- 7-Oxabicyclo[4.1.0]heptane-3-carboxylic acid, pentadecyl ester
- pentadecyl 7-oxabicyclo[4.1.0]heptane-4-carboxylate
- DTXSID80810200
- PENTADECYL 7-OXABICYCLO[4.1.0]HEPTANE-3-CARBOXYLATE
- 62266-62-0
-
- Inchi： 1S/C22H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-22(23)19-15-16-20-21(18-19)25-20/h19-21H,2-18H2,1H3
- InChI Key： XLZMDTKHAHQRNK-UHFFFAOYSA-N
- SMILES： O1C2CCC(C(=O)OCCCCCCCCCCCCCCC)CC12
Computed Properties
- Exact Mass: 352.2979
- Monoisotopic Mass: 352.29774513g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 25
- Rotatable Bond Count: 16
- Complexity: 355
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 7.9
- Topological Polar Surface Area: 38.8?2
Experimental Properties
- PSA: 38.83
7-Oxabicyclo[4.1.0]heptane-3-carboxylic acid, pentadecyl ester Related Literature
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
-
José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
62266-62-0 (7-Oxabicyclo[4.1.0]heptane-3-carboxylic acid, pentadecyl ester) Related Products
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