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Home > Fluorides > 1707358-78-8
1707358-78-8 | 4-Fluoro-3-(tetrahydro-2H-pyran-4-yl)-1H-indole
CAS No: 1707358-78-8 Catalog No: AG01F9WV MDL No:
Product Description
Catalog Number:
AG01F9WV
Chemical Name:
4-Fluoro-3-(tetrahydro-2H-pyran-4-yl)-1H-indole
CAS Number:
1707358-78-8
Molecular Formula:
C13H14FNO
Molecular Weight:
219.2548
IUPAC Name:
4-fluoro-3-(oxan-4-yl)-1H-indole
InChI:
InChI=1S/C13H14FNO/c14-11-2-1-3-12-13(11)10(8-15-12)9-4-6-16-7-5-9/h1-3,8-9,15H,4-7H2
InChI Key:
DIHWQLSKNISJOX-UHFFFAOYSA-N
SMILES:
Fc1cccc2c1c(c[nH]2)C1CCOCC1
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.259g/mol
Monoisotopic Mass:
219.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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