Cas no 89013-81-0 (7-Oxabicyclo[4.1.0]heptane-3,4-dicarboxylic acid, dinonadecyl ester)
![7-Oxabicyclo[4.1.0]heptane-3,4-dicarboxylic acid, dinonadecyl ester structure](https://ossimg.kuujia.com/scimg/89500/89013-81-0x500.png)
89013-81-0 structure
Product Name:7-Oxabicyclo[4.1.0]heptane-3,4-dicarboxylic acid, dinonadecyl ester
CAS No:89013-81-0
MF:C46H86O5
MW:719.172055721283
CID:615878
PubChem ID:71321441
Update Time:2025-04-19
7-Oxabicyclo[4.1.0]heptane-3,4-dicarboxylic acid, dinonadecyl ester Chemical and Physical Properties
Names and Identifiers
-
- 7-Oxabicyclo[4.1.0]heptane-3,4-dicarboxylic acid, dinonadecyl ester
- dinonadecyl 7-oxabicyclo[4.1.0]heptane-3,4-dicarboxylate
- 89013-81-0
- DTXSID00751262
-
- Inchi： 1S/C46H86O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-49-45(47)41-39-43-44(51-43)40-42(41)46(48)50-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h41-44H,3-40H2,1-2H3
- InChI Key： HIVGEEXONJVUAL-UHFFFAOYSA-N
- SMILES： O1C2CC(C(=O)OCCCCCCCCCCCCCCCCCCC)C(C(=O)OCCCCCCCCCCCCCCCCCCC)CC12
Computed Properties
- Exact Mass: 718.64752584g/mol
- Monoisotopic Mass: 718.64752584g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 51
- Rotatable Bond Count: 40
- Complexity: 735
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 18.9
- Topological Polar Surface Area: 65.1?2
7-Oxabicyclo[4.1.0]heptane-3,4-dicarboxylic acid, dinonadecyl ester Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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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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5. Exclusive enantioselective recognition of glucopyranosides by inherently chiral hemicryptophanes?Olivier Perraud,Alexandre Martinez,Jean-Pierre Dutasta Chem. Commun., 2011,47, 5861-5863
89013-81-0 (7-Oxabicyclo[4.1.0]heptane-3,4-dicarboxylic acid, dinonadecyl ester) Related Products
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