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1002726-80-8 | 3-Piperidinol, 1-(4-amino-2-fluorophenyl)-
CAS No: 1002726-80-8 Catalog No: AG0001FF MDL No:
Product Description
Catalog Number:
AG0001FF
Chemical Name:
3-Piperidinol, 1-(4-amino-2-fluorophenyl)-
CAS Number:
1002726-80-8
Molecular Formula:
C11H15FN2O
Molecular Weight:
210.2480
IUPAC Name:
1-(4-amino-2-fluorophenyl)piperidin-3-ol
InChI:
InChI=1S/C11H15FN2O/c12-10-6-8(13)3-4-11(10)14-5-1-2-9(15)7-14/h3-4,6,9,15H,1-2,5,7,13H2
InChI Key:
PLQNWZZMUWFFOI-UHFFFAOYSA-N
SMILES:
OC1CCCN(C1)c1ccc(cc1F)N
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.117g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.252g/mol
Monoisotopic Mass:
210.117g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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