Cas no 885520-68-3 (4-bromo-6-fluoro-2H-indazole-3-carbaldehyde)
885520-68-3 structure
Product Name:4-bromo-6-fluoro-2H-indazole-3-carbaldehyde
CAS No:885520-68-3
MF:C8H4BrFN2O
MW:243.032564163208
CID:2625993
PubChem ID:24728172
Update Time:2025-04-21
4-bromo-6-fluoro-2H-indazole-3-carbaldehyde Chemical and Physical Properties
Names and Identifiers
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- 4-bromo-6-fluoro-2H-indazole-3-carbaldehyde
- 4-BROMO-6-FLUORO-(1H)INDAZOLE CARBOXALDEHYDE
- DTXSID90646234
- 885520-68-3
- 4-BROMO-6-FLUORO-1H-INDAZOLE-3-CARBALDEHYDE
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- Inchi： 1S/C8H4BrFN2O/c9-5-1-4(10)2-6-8(5)7(3-13)12-11-6/h1-3H,(H,11,12)
- InChI Key： WIGPBERBKUHDNM-UHFFFAOYSA-N
- SMILES： BrC1=CC(=CC2C1=C(C=O)NN=2)F
Computed Properties
- Exact Mass: 241.949
- Monoisotopic Mass: 241.949
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 216
- 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
- Topological Polar Surface Area: 45.8A^2
- XLogP3: 2.1
4-bromo-6-fluoro-2H-indazole-3-carbaldehyde Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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