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1017789-26-2 | Benzamide, 2-amino-3-fluoro-N-methyl-
CAS No: 1017789-26-2 Catalog No: AG0005J2 MDL No:
Product Description
Catalog Number:
AG0005J2
Chemical Name:
Benzamide, 2-amino-3-fluoro-N-methyl-
CAS Number:
1017789-26-2
Molecular Formula:
C8H9FN2O
Molecular Weight:
168.1683
IUPAC Name:
2-amino-3-fluoro-N-methylbenzamide
InChI:
InChI=1S/C8H9FN2O/c1-11-8(12)5-3-2-4-6(9)7(5)10/h2-4H,10H2,1H3,(H,11,12)
InChI Key:
XUPIMWRWXRQZEO-UHFFFAOYSA-N
SMILES:
CNC(=O)c1cccc(c1N)F
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.07g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
168.171g/mol
Monoisotopic Mass:
168.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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