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| Synonyms | 2,7-oxepanedion | SCHEMBL320487 | EN300-41706 | CS-W019642 | SY033154 | 2,7-Oxepanedione, 9CI | F20518 | Adipic anhydride | DTXSID401316648 | adipic acid anhydride | FT-0651100 | BBL100131 | CHEBI:173481 | 3-propyloxetane-2,4-dione | Adipicanhydride | Oxe |
|---|---|
| Specifications & Purity | ≥90% |
| Storage Temp | Store at 2-8°C,Argon charged |
| Shipped In |
Wet ice This product requires cold chain shipping. Ground and other economy services are not available. |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Lactones |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Lactones |
| Alternative Parents | Oxepanes Dicarboxylic acids and derivatives Carboxylic acid anhydrides Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | Caprolactone - Oxepane - Dicarboxylic acid or derivatives - Carboxylic acid anhydride - Lactone - Oxacycle - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as lactones. These are cyclic esters of hydroxy carboxylic acids, containing a 1-oxacycloalkan-2-one structure, or analogues having unsaturation or heteroatoms replacing one or more carbon atoms of the ring. |
| External Descriptors | Not available |
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| IUPAC Name | oxepane-2,7-dione |
|---|---|
| INCHI | InChI=1S/C6H8O3/c7-5-3-1-2-4-6(8)9-5/h1-4H2 |
| InChIKey | JPSKCQCQZUGWNM-UHFFFAOYSA-N |
| Smiles | C1CCC(=O)OC(=O)C1 |
| Isomeric SMILES | C1CCC(=O)OC(=O)C1 |
| Molecular Weight | 128.13 |
| Reaxy-Rn | 2945 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2945&ln= |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Jul 31, 2023 | O588008 | |
| Certificate of Analysis | Jul 31, 2023 | O588008 | |
| Certificate of Analysis | Jul 31, 2023 | O588008 | |
| Certificate of Analysis | Jul 31, 2023 | O588008 |
| Molecular Weight | 128.130 g/mol |
|---|---|
| XLogP3 | 0.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 128.047 Da |
| Monoisotopic Mass | 128.047 Da |
| Topological Polar Surface Area | 43.400 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 123.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Yuchen Bai, Hui Jiang, Yingjie Zhang, Leina Dou, Minggang Liu, Wenbo Yu, Kai Wen, Jianzhong Shen, Yuebin Ke, Xuezhi Yu, Zhanhui Wang. (2021) Hydrophobic Moiety of Capsaicinoids Haptens Enhancing Antibody Performance in Immunoassay: Evidence from Computational Chemistry and Molecular Recognition. JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY, 69 (34): (9957–9967). |
| 2. Xiao Kuang, Yuting Hu, Dongxu Chi, Haolin Zhang, Zhonggui He, Yiguo Jiang, Yongjun Wang. (2021) Self-stabilized Pt(IV) amphiphiles by precise regulation of branch length for enhanced chemotherapy. INTERNATIONAL JOURNAL OF PHARMACEUTICS, 606 (120923). |
| 3. Hengjie Zhang, Yuqi Feng, Tianyou Wang, Jianhua Zhang, Yuxian Song, Jing Zhang, Yiwen Li, Dingzi Zhou, Zhipeng Gu. (2024) Natural polyphenolic antibacterial bio-adhesives for infected wound healing. Biomaterials Science, |