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1000343-96-3 | 1H-Indazole, 3-chloro-6,7-difluoro-
CAS No: 1000343-96-3 Catalog No: AG0000M3 MDL No:
Product Description
Catalog Number:
AG0000M3
Chemical Name:
1H-Indazole, 3-chloro-6,7-difluoro-
CAS Number:
1000343-96-3
Molecular Formula:
C7H3ClF2N2
Molecular Weight:
188.5619
IUPAC Name:
3-chloro-6,7-difluoro-2H-indazole
InChI:
InChI=1S/C7H3ClF2N2/c8-7-3-1-2-4(9)5(10)6(3)11-12-7/h1-2H,(H,11,12)
InChI Key:
QNOUURXTRUTJRZ-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1F)[nH]nc2Cl
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.995g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.562g/mol
Monoisotopic Mass:
187.995g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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