Cas no 1379364-11-0 (3-bromo-7-fluoro-1,2-benzoxazole)
1379364-11-0 structure
Product Name:3-bromo-7-fluoro-1,2-benzoxazole
CAS No:1379364-11-0
MF:C7H3BrFNO
MW:216.007224321365
CID:6833379
PubChem ID:83835826
Update Time:2025-03-27
3-bromo-7-fluoro-1,2-benzoxazole Chemical and Physical Properties
Names and Identifiers
-
- 3-Bromo-7-fluorobenzo[d]isoxazole
- 1379364-11-0
- 3-bromo-7-fluoro-1,2-benzoxazole
-
- Inchi： 1S/C7H3BrFNO/c8-7-4-2-1-3-5(9)6(4)11-10-7/h1-3H
- InChI Key： ISCACEDADJYNBM-UHFFFAOYSA-N
- SMILES： BrC1C2C=CC=C(C=2ON=1)F
Computed Properties
- Exact Mass: 214.93820Da
- Monoisotopic Mass: 214.93820Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- 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: 2.8
- Topological Polar Surface Area: 26?2
3-bromo-7-fluoro-1,2-benzoxazole Related Literature
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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