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Home > Fluorides > 912894-29-2
912894-29-2 | 1-(2-Fluoro-4-nitrophenyl)piperidine-4-carboxamide
CAS No: 912894-29-2 Catalog No: AG01EZ0V MDL No:
Product Description
Catalog Number:
AG01EZ0V
Chemical Name:
1-(2-Fluoro-4-nitrophenyl)piperidine-4-carboxamide
CAS Number:
912894-29-2
Molecular Formula:
C12H14FN3O3
Molecular Weight:
267.2563
IUPAC Name:
1-(2-fluoro-4-nitrophenyl)piperidine-4-carboxamide
InChI:
InChI=1S/C12H14FN3O3/c13-10-7-9(16(18)19)1-2-11(10)15-5-3-8(4-6-15)12(14)17/h1-2,7-8H,3-6H2,(H2,14,17)
InChI Key:
FGOQYAIMZGNCRE-UHFFFAOYSA-N
SMILES:
NC(=O)C1CCN(CC1)c1ccc(cc1F)[N+](=O)[O-]
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.102g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.26g/mol
Monoisotopic Mass:
267.102g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
92.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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