Cas no 342616-12-0 (2,4-Dioxabicyclo[3.3.1]nona-1,1(9),3,5(9),5,7-hexaene-6-carboxaldehyde)
![2,4-Dioxabicyclo[3.3.1]nona-1,1(9),3,5(9),5,7-hexaene-6-carboxaldehyde structure](https://ossimg.kuujia.com/scimg/343000/342616-12-0x500.png)
342616-12-0 structure
Product Name:2,4-Dioxabicyclo[3.3.1]nona-1,1(9),3,5(9),5,7-hexaene-6-carboxaldehyde
CAS No:342616-12-0
MF:C8H6O3
MW:150.131442546844
CID:302256
PubChem ID:12466135
Update Time:2025-04-19
2,4-Dioxabicyclo[3.3.1]nona-1,1(9),3,5(9),5,7-hexaene-6-carboxaldehyde Chemical and Physical Properties
Names and Identifiers
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- 2,4-Dioxabicyclo[3.3.1]nona-1,1(9),3,5(9),5,7-hexaene-6-carboxaldehyde
- 2,4-Dioxabicyclo[3.3.1]nona-1(9),5,7-triene-6-carboxaldehyde(9CI)
- 2,4-dioxabicyclo[3.3.1]nona-1(9),5,7-triene-6-carbaldehyde
- 342616-12-0
- DTXSID90499363
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- Inchi： 1S/C8H6O3/c9-4-6-1-2-7-3-8(6)11-5-10-7/h1-4H,5H2
- InChI Key： LYPCIHQOERORHG-UHFFFAOYSA-N
- SMILES： O1COC2C=CC(C=O)=C1C=2
Computed Properties
- Exact Mass: 150.031694049g/mol
- Monoisotopic Mass: 150.031694049g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 157
- 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: 1.2
- Topological Polar Surface Area: 35.5?2
2,4-Dioxabicyclo[3.3.1]nona-1,1(9),3,5(9),5,7-hexaene-6-carboxaldehyde Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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