Cas no 887568-20-9 (3,4-dichloro-6-iodo-1h-indazole)
887568-20-9 structure
Product Name:3,4-dichloro-6-iodo-1h-indazole
CAS No:887568-20-9
MF:C7H3Cl2IN2
MW:312.92259144783
CID:1929696
PubChem ID:24728465
Update Time:2025-04-21
3,4-dichloro-6-iodo-1h-indazole Chemical and Physical Properties
Names and Identifiers
-
- 3,4-Dichloro-6-iodo-1H-indazole
- 3,4-DICHLORO-6-IODO (1H)INDAZOLE
- 3,4-dichloro-6-iodo-2H-indazole
- 887568-20-9
- 3,4-dichloro-6-iodo-1h-indazole
-
- Inchi： 1S/C7H3Cl2IN2/c8-4-1-3(10)2-5-6(4)7(9)12-11-5/h1-2H,(H,11,12)
- InChI Key： CQMATEDOTACVCW-UHFFFAOYSA-N
- SMILES： IC1C=C(C2=C(NN=C2C=1)Cl)Cl
Computed Properties
- Exact Mass: 311.87180Da
- Monoisotopic Mass: 311.87180Da
- 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: 3.8
- Topological Polar Surface Area: 28.7?2
3,4-dichloro-6-iodo-1h-indazole Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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