Cas no 4891-67-2 (3-oxabicyclo[3.3.1]nona-1(9),5,7-triene-2,4-dione)
![3-oxabicyclo[3.3.1]nona-1(9),5,7-triene-2,4-dione structure](https://ossimg.kuujia.com/scimg/5000/4891-67-2x500.png)
4891-67-2 structure
Product Name:3-oxabicyclo[3.3.1]nona-1(9),5,7-triene-2,4-dione
3-oxabicyclo[3.3.1]nona-1(9),5,7-triene-2,4-dione Chemical and Physical Properties
Names and Identifiers
-
- 3-oxabicyclo[3.3.1]nona-1(9),5,7-triene-2,4-dione
- LS-13397
- JK59C6Z8NT
- J637.985K
- 3-Oxabicyclo(3.3.1)nona-1(9),5,7-triene-2,4-dione
- UNII-JK59C6Z8NT
- Q27281540
- SCHEMBL27505
- DTXSID0041488
- isophthalic anhydride
- NS00123235
- 4891-67-2
-
- Inchi： 1S/C8H4O3/c9-7-5-2-1-3-6(4-5)8(10)11-7/h1-4H
- InChI Key： LNYYKKTXWBNIOO-UHFFFAOYSA-N
- SMILES： O=C1C2C=C(C=CC=2)C(=O)O1
Computed Properties
- Exact Mass: 148.016
- Monoisotopic Mass: 148.016
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 189
- 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
- Topological Polar Surface Area: 43.4A^2
- XLogP3: 1.3
Experimental Properties
- Density: 1.444
- Boiling Point: 295°C at 760 mmHg
- Flash Point: 143.8°C
- Refractive Index: 1.612
3-oxabicyclo[3.3.1]nona-1(9),5,7-triene-2,4-dione Related Literature
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
4891-67-2 (3-oxabicyclo[3.3.1]nona-1(9),5,7-triene-2,4-dione) Related Products
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