Cas no 1260853-69-7 (5-Chloro-3-iodo-1-methyl-1H-indazole)
1260853-69-7 structure
Product Name:5-Chloro-3-iodo-1-methyl-1H-indazole
CAS No:1260853-69-7
MF:C8H6ClIN2
MW:292.50411272049
CID:2107734
PubChem ID:20816301
Update Time:2024-03-01
5-Chloro-3-iodo-1-methyl-1H-indazole Chemical and Physical Properties
Names and Identifiers
-
- 5-chloro-3-iodo-1-methyl-1H-indazole
- 5-Chloro-3-iodo-1-methyl-1H-indazole
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- Inchi： 1S/C8H6ClIN2/c1-12-7-3-2-5(9)4-6(7)8(10)11-12/h2-4H,1H3
- InChI Key： DZQSEJIIEJWGJH-UHFFFAOYSA-N
- SMILES： IC1C2C=C(C=CC=2N(C)N=1)Cl
Computed Properties
- Exact Mass: 291.92642g/mol
- Monoisotopic Mass: 291.92642g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 178
- 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: 17.8
- XLogP3: 2.9
5-Chloro-3-iodo-1-methyl-1H-indazole Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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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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