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1000342-09-5 | 1H-Indazole, 7-chloro-4-fluoro-3-iodo-
CAS No: 1000342-09-5 Catalog No: AG0000IY MDL No:
Product Description
Catalog Number:
AG0000IY
Chemical Name:
1H-Indazole, 7-chloro-4-fluoro-3-iodo-
CAS Number:
1000342-09-5
Molecular Formula:
C7H3ClFIN2
Molecular Weight:
296.4680
IUPAC Name:
7-chloro-4-fluoro-3-iodo-2H-indazole
InChI:
InChI=1S/C7H3ClFIN2/c8-3-1-2-4(9)5-6(3)11-12-7(5)10/h1-2H,(H,11,12)
InChI Key:
QHODPGTVJUGODH-UHFFFAOYSA-N
SMILES:
Fc1ccc(c2c1c(I)n[nH]2)Cl
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.901g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.468g/mol
Monoisotopic Mass:
295.901g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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