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Home > Fluorides > 115031-82-8
115031-82-8 | 7(1H)-Indolizinone, 2-(2-fluorophenyl)hexahydro-, trans- (9CI)
CAS No: 115031-82-8 Catalog No: AG000FQS MDL No:
Product Description
Catalog Number:
AG000FQS
Chemical Name:
7(1H)-Indolizinone, 2-(2-fluorophenyl)hexahydro-, trans- (9CI)
CAS Number:
115031-82-8
Molecular Formula:
C14H16FNO
Molecular Weight:
233.2813
IUPAC Name:
2-(2-fluorophenyl)-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-one
InChI:
InChI=1S/C14H16FNO/c15-14-4-2-1-3-13(14)10-7-11-8-12(17)5-6-16(11)9-10/h1-4,10-11H,5-9H2
InChI Key:
YDYXSUWRRBQAET-UHFFFAOYSA-N
SMILES:
O=C1CCN2[C@@H](C1)C[C@H](C2)c1ccccc1F
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.122g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.286g/mol
Monoisotopic Mass:
233.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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