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1000340-79-3 | 1H-Indazole, 3-chloro-4-fluoro-
CAS No: 1000340-79-3 Catalog No: AG0000FJ MDL No:
Product Description
Catalog Number:
AG0000FJ
Chemical Name:
1H-Indazole, 3-chloro-4-fluoro-
CAS Number:
1000340-79-3
Molecular Formula:
C7H4ClFN2
Molecular Weight:
170.5715
IUPAC Name:
3-chloro-4-fluoro-2H-indazole
InChI:
InChI=1S/C7H4ClFN2/c8-7-6-4(9)2-1-3-5(6)10-11-7/h1-3H,(H,10,11)
InChI Key:
JLJQBQRJMZSFQZ-UHFFFAOYSA-N
SMILES:
Fc1cccc2c1c(Cl)n[nH]2
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.005g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.571g/mol
Monoisotopic Mass:
170.005g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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