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1000341-62-7 | 1H-Indazole, 3,5-dichloro-4-fluoro-6-iodo-
CAS No: 1000341-62-7 Catalog No: AG0000HG MDL No:
Product Description
Catalog Number:
AG0000HG
Chemical Name:
1H-Indazole, 3,5-dichloro-4-fluoro-6-iodo-
CAS Number:
1000341-62-7
Molecular Formula:
C7H2Cl2FIN2
Molecular Weight:
330.9131
IUPAC Name:
3,5-dichloro-4-fluoro-6-iodo-2H-indazole
InChI:
InChI=1S/C7H2Cl2FIN2/c8-5-2(11)1-3-4(6(5)10)7(9)13-12-3/h1H,(H,12,13)
InChI Key:
KGKZRJMDLGTFLF-UHFFFAOYSA-N
SMILES:
Ic1cc2[nH]nc(c2c(c1Cl)F)Cl
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.862g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
330.91g/mol
Monoisotopic Mass:
329.862g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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