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Home > Fluorides > 824968-65-2
824968-65-2 | 1H-Pyrazolo[4,3-c]isoquinoline, 5-(2-fluorophenyl)-3-methyl-
CAS No: 824968-65-2 Catalog No: AG004URJ MDL No:
Product Description
Catalog Number:
AG004URJ
Chemical Name:
1H-Pyrazolo[4,3-c]isoquinoline, 5-(2-fluorophenyl)-3-methyl-
CAS Number:
824968-65-2
Molecular Formula:
C17H12FN3
Molecular Weight:
277.2957
IUPAC Name:
5-(2-fluorophenyl)-3-methyl-2H-pyrazolo[4,3-c]isoquinoline
InChI:
InChI=1S/C17H12FN3/c1-10-15-17(21-20-10)12-7-3-2-6-11(12)16(19-15)13-8-4-5-9-14(13)18/h2-9H,1H3,(H,20,21)
InChI Key:
PAKGFLYKLYMXQC-UHFFFAOYSA-N
SMILES:
Fc1ccccc1c1nc2c(C)n[nH]c2c2c1cccc2
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.102g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.302g/mol
Monoisotopic Mass:
277.102g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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