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1478-85-9 | Piperazine, 1-(3-fluoro-4-methylphenyl)-
CAS No: 1478-85-9 Catalog No: AG001F88 MDL No:
Product Description
Catalog Number:
AG001F88
Chemical Name:
Piperazine, 1-(3-fluoro-4-methylphenyl)-
CAS Number:
1478-85-9
Molecular Formula:
C11H15FN2
Molecular Weight:
194.2486
IUPAC Name:
1-(3-fluoro-4-methylphenyl)piperazine
InChI:
InChI=1S/C11H15FN2/c1-9-2-3-10(8-11(9)12)14-6-4-13-5-7-14/h2-3,8,13H,4-7H2,1H3
InChI Key:
ITHWXVKXRQBHIG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1F)N1CCNCC1
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.122g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.253g/mol
Monoisotopic Mass:
194.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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