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1196151-78-6 | 1H-Imidazol-4-amine, 1-(4-fluorophenyl)-
CAS No: 1196151-78-6 Catalog No: AG000PAB MDL No:MFCD13189639
Product Description
Catalog Number:
AG000PAB
Chemical Name:
1H-Imidazol-4-amine, 1-(4-fluorophenyl)-
CAS Number:
1196151-78-6
Molecular Formula:
C9H8FN3
Molecular Weight:
177.1783
MDL Number:
MFCD13189639
IUPAC Name:
1-(4-fluorophenyl)imidazol-4-amine
InChI:
InChI=1S/C9H8FN3/c10-7-1-3-8(4-2-7)13-5-9(11)12-6-13/h1-6H,11H2
InChI Key:
HSJHWNAOMDKSOF-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)n1cnc(c1)N
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.182g/mol
Monoisotopic Mass:
177.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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