Cas no 887568-59-4 (3,6-Dibromo-4-iodo (1H)indazole)
887568-59-4 structure
Product Name:3,6-Dibromo-4-iodo (1H)indazole
CAS No:887568-59-4
MF:C7H3Br2IN2
MW:401.824591875076
CID:3152768
PubChem ID:24728494
Update Time:2025-04-21
3,6-Dibromo-4-iodo (1H)indazole Chemical and Physical Properties
Names and Identifiers
-
- 3,6-Dibromo-4-iodo (1H)indazole
- 887568-59-4
- 3,6-dibromo-4-iodo-2H-indazole
- DB-203996
- 3,6-DIBROMO-4-IODO-1H-INDAZOLE
- 3,6-Dibromo-4-iodo(1h)indazole
-
- Inchi： 1S/C7H3Br2IN2/c8-3-1-4(10)6-5(2-3)11-12-7(6)9/h1-2H,(H,11,12)
- InChI Key： VDBXYUKVJLIMKB-UHFFFAOYSA-N
- SMILES： IC1=CC(=CC2C1=C(NN=2)Br)Br
Computed Properties
- Exact Mass: 401.76872Da
- Monoisotopic Mass: 399.77077Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 181
- 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: 3.9
- Topological Polar Surface Area: 28.7?2
3,6-Dibromo-4-iodo (1H)indazole Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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