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Home > Fluorides > 2029175-99-1
2029175-99-1 | 2-Fluoro-N-methyl-4-(trifluoromethyl)-benzamide
CAS No: 2029175-99-1 Catalog No: AG01EUHS MDL No:
Product Description
Catalog Number:
AG01EUHS
Chemical Name:
2-Fluoro-N-methyl-4-(trifluoromethyl)-benzamide
CAS Number:
2029175-99-1
Molecular Formula:
C9H7F4NO
Molecular Weight:
221.1516
IUPAC Name:
2-fluoro-N-methyl-4-(trifluoromethyl)benzamide
InChI:
InChI=1S/C9H7F4NO/c1-14-8(15)6-3-2-5(4-7(6)10)9(11,12)13/h2-4H,1H3,(H,14,15)
InChI Key:
OLCDIAITVHRPNL-UHFFFAOYSA-N
SMILES:
CNC(=O)c1ccc(cc1F)C(F)(F)F
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.046g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.155g/mol
Monoisotopic Mass:
221.046g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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