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76315-55-4 | 6-Fluoro-3-(piperidin-4-yl)-1H-indole
CAS No: 76315-55-4 Catalog No: AG005E6O MDL No:MFCD04114735
Product Description
Catalog Number:
AG005E6O
Chemical Name:
6-Fluoro-3-(piperidin-4-yl)-1H-indole
CAS Number:
76315-55-4
Molecular Formula:
C13H15FN2
Molecular Weight:
218.2700
MDL Number:
MFCD04114735
IUPAC Name:
6-fluoro-3-piperidin-4-yl-1H-indole
InChI:
InChI=1S/C13H15FN2/c14-10-1-2-11-12(8-16-13(11)7-10)9-3-5-15-6-4-9/h1-2,7-9,15-16H,3-6H2
InChI Key:
VNEIHOLJEZRVCL-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)[nH]cc2C1CCNCC1
Properties
Complexity:
240
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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