1-[2-(4-fluorophenyl)ethynyl]-4-propylbenzene

1-[2-(4-fluorophenyl)ethynyl]-4-propylbenzene

CAS: 145698-32-4

Formula: C17H15F

SMILES: CCCC1=CC=C(C=C1)C#CC1=CC=C(F)C=C1

IUPAC: 1-[2-(4-fluorophenyl)ethynyl]-4-propylbenzene

InChI: InChI=1S/C17H15F/c1-2-3-14-4-6-15(7-5-14)8-9-16-10-12-17(18)13-11-16/h4-7,10-13H,2-3H2,1H3

Composition: C (85.68%), H (6.34%), F (7.97%)

Molar Mass: 238.305

Atom Count: 33

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	238.115778646
Formal Charge	0
FSP3	0.18
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	VQFRZGGKKHHZML-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	68.35
Topological Polar Surface Area	0
Polarizability	27.6
Ring Count	2
Rotatable Bond Count	4

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