1-(4-fluorophenyl)prop-2-yn-1-one

1-(4-fluorophenyl)prop-2-yn-1-one

CAS: 54012-23-6

Formula: C9H5FO

SMILES: FC1=CC=C(C=C1)C(=O)C#C

IUPAC: 1-(4-fluorophenyl)prop-2-yn-1-one

InChI: InChI=1S/C9H5FO/c1-2-9(11)7-3-5-8(10)6-4-7/h1,3-6H

Composition: C (72.97%), H (3.40%), F (12.82%), O (10.80%)

Molar Mass: 148.136

Atom Count: 16

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	148.032442944
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	ACUGGDVMDPMOFH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.82
Topological Polar Surface Area	17.07
Polarizability	14.47
Ring Count	1
Rotatable Bond Count	1

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