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2-(3-fluorophenyl)-1,3-dithiane

2-(3-fluorophenyl)-1,3-dithiane

CAS: 57009-75-3

Formula: C10H11FS2

SMILES: FC1=CC=CC(=C1)C1SCCCS1

IUPAC: 2-(3-fluorophenyl)-1,3-dithiane

InChI: InChI=1S/C10H11FS2/c11-9-4-1-3-8(7-9)10-12-5-2-6-13-10/h1,3-4,7,10H,2,5-6H2

Composition: C (56.04%), H (5.17%), F (8.86%), S (29.92%)

Molar Mass: 214.32

Atom Count: 24

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 214.028620865
Formal Charge 0
FSP3 0.4
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey FFQFYDRRUQYEKL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.72
Topological Polar Surface Area 0
Polarizability 22.74
Ring Count 2
Rotatable Bond Count 1

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