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66607-27-0 | 3-Iodo-1H-indazole
CAS No: 66607-27-0 Catalog No: AG00H83K MDL No:MFCD04972469
Product Description
Catalog Number:
AG00H83K
Chemical Name:
3-Iodo-1H-indazole
CAS Number:
66607-27-0
Molecular Formula:
C7H5IN2
Molecular Weight:
244.0325
MDL Number:
MFCD04972469
IUPAC Name:
3-iodo-2H-indazole
InChI:
InChI=1S/C7H5IN2/c8-7-5-3-1-2-4-6(5)9-10-7/h1-4H,(H,9,10)
InChI Key:
UDKYMMQGPNFWDA-UHFFFAOYSA-N
SMILES:
Ic1n[nH]c2c1cccc2
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.95g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.035g/mol
Monoisotopic Mass:
243.95g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Design, synthesis and biological evaluation of Trypanosoma brucei trypanothione synthetase inhibitors. | ChemMedChem 20120102 |
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