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Home > Fluorides > 695213-99-1
695213-99-1 | 5-Fluoro-3-(piperidin-3-yl)-1H-indole
CAS No: 695213-99-1 Catalog No: AG01EX03 MDL No:MFCD17487625
Product Description
Catalog Number:
AG01EX03
Chemical Name:
5-Fluoro-3-(piperidin-3-yl)-1H-indole
CAS Number:
695213-99-1
Molecular Formula:
C13H15FN2
Molecular Weight:
218.2700
MDL Number:
MFCD17487625
IUPAC Name:
5-fluoro-3-piperidin-3-yl-1H-indole
InChI:
InChI=1S/C13H15FN2/c14-10-3-4-13-11(6-10)12(8-16-13)9-2-1-5-15-7-9/h3-4,6,8-9,15-16H,1-2,5,7H2
InChI Key:
DOFKTGJHTOAAJF-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)c(c[nH]2)C1CCCNC1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.122g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
218.275g/mol
Monoisotopic Mass:
218.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
27.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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