Cas no 130700-87-7 (Furo[3,4-f]benzoxazole(9CI))
Furo[3,4-f]benzoxazole(9CI) structure
Product Name:Furo[3,4-f]benzoxazole(9CI)
CAS No:130700-87-7
MF:C9H5NO2
MW:159.141502141953
CID:102511
PubChem ID:45120274
Update Time:2025-04-18
Furo[3,4-f]benzoxazole(9CI) Chemical and Physical Properties
Names and Identifiers
-
- Furo[3,4-f]benzoxazole(9CI)
- furo[3,4-f][1,3]benzoxazole
- DTXSID20668969
- 130700-87-7
- Isobenzofuro[5,6-d]oxazole
- Furo[3,4-f]benzoxazole (9CI)
-
- Inchi: 1S/C9H5NO2/c1-6-3-11-4-7(6)2-9-8(1)10-5-12-9/h1-5H
- InChI Key: OAOZEGIAHWTUOM-UHFFFAOYSA-N
- SMILES: O1C=NC2=CC3=COC=C3C=C12
Computed Properties
- Exact Mass: 159.03205
- Monoisotopic Mass: 159.032028402g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 185
- 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: 2.1
- Topological Polar Surface Area: 39.2?2
Experimental Properties
- PSA: 39.17
Furo[3,4-f]benzoxazole(9CI) Related Literature
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Xingjie Wu,Linzhu Zhou,Yue Su,Chang-Ming Dong J. Mater. Chem. B, 2016,4, 2142-2152
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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