Cas no 155181-15-0 (1,3-Dioxolo[4,5-e][1,2]benzisoxazole(9CI))
![1,3-Dioxolo[4,5-e][1,2]benzisoxazole(9CI) structure](https://ossimg.kuujia.com/scimg/155500/155181-15-0x500.png)
155181-15-0 structure
Product Name:1,3-Dioxolo[4,5-e][1,2]benzisoxazole(9CI)
CAS No:155181-15-0
MF:C8H5NO3
MW:163.130202054977
CID:106886
PubChem ID:57348874
Update Time:2025-04-18
1,3-Dioxolo[4,5-e][1,2]benzisoxazole(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Dioxolo[4,5-e][1,2]benzisoxazole(9CI)
- [1,3]dioxolo[4,5-e][1,2]benzoxazole
- [1,3]Dioxolo[4',5':5,6]benzo[1,2-d]isoxazole
- 155181-15-0
- DTXSID40721722
- 2H-[1,3]Dioxolo[4,5-e][1,2]benzoxazole
-
- Inchi： 1S/C8H5NO3/c1-2-7-8(11-4-10-7)5-3-9-12-6(1)5/h1-3H,4H2
- InChI Key： ZFTUYNLXSLFRIS-UHFFFAOYSA-N
- SMILES： O1COC2=CC=C3C(C=NO3)=C12
Computed Properties
- Exact Mass: 163.02695
- Monoisotopic Mass: 163.026943022g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 187
- 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: 1.5
- Topological Polar Surface Area: 44.5?2
Experimental Properties
- PSA: 44.49
1,3-Dioxolo[4,5-e][1,2]benzisoxazole(9CI) Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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