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Home > Fluorides > 942474-32-0
942474-32-0 | 1-(4-Fluoro-2-nitrophenyl)-3-methylpiperidine
CAS No: 942474-32-0 Catalog No: AG01EZFK MDL No:MFCD08692445
Product Description
Catalog Number:
AG01EZFK
Chemical Name:
1-(4-Fluoro-2-nitrophenyl)-3-methylpiperidine
CAS Number:
942474-32-0
Molecular Formula:
C12H15FN2O2
Molecular Weight:
238.2581
MDL Number:
MFCD08692445
IUPAC Name:
1-(4-fluoro-2-nitrophenyl)-3-methylpiperidine
InChI:
InChI=1S/C12H15FN2O2/c1-9-3-2-6-14(8-9)11-5-4-10(13)7-12(11)15(16)17/h4-5,7,9H,2-3,6,8H2,1H3
InChI Key:
HFQNWLQOEOPCLA-UHFFFAOYSA-N
SMILES:
CC1CCCN(C1)c1ccc(cc1[N+](=O)[O-])F
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.112g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.262g/mol
Monoisotopic Mass:
238.112g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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