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Home > Fluorides > 221198-99-8
221198-99-8 | 3-Fluoro-4-(4-methyl-1-piperazinyl)aniline
CAS No: 221198-99-8 Catalog No: AG0033P4 MDL No:MFCD05663793
Product Description
Catalog Number:
AG0033P4
Chemical Name:
3-Fluoro-4-(4-methyl-1-piperazinyl)aniline
CAS Number:
221198-99-8
Molecular Formula:
C11H16FN3
Molecular Weight:
209.2632
MDL Number:
MFCD05663793
IUPAC Name:
3-fluoro-4-(4-methylpiperazin-1-yl)aniline
InChI:
InChI=1S/C11H16FN3/c1-14-4-6-15(7-5-14)11-3-2-9(13)8-10(11)12/h2-3,8H,4-7,13H2,1H3
InChI Key:
GOPUCAPKOUZKPS-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)c1ccc(cc1F)N
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.133g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.268g/mol
Monoisotopic Mass:
209.133g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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