4,4,5,5,5-pentafluoro-1-hydroxy-1-(thiophen-2-yl)pent-1-en-3-one

4,4,5,5,5-pentafluoro-1-hydroxy-1-(thiophen-2-yl)pent-1-en-3-one

CAS: 1994-18-9

Formula: C9H5F5O2S

SMILES: OC(=CC(=O)C(F)(F)C(F)(F)F)C1=CC=CS1

IUPAC: 4,4,5,5,5-pentafluoro-1-hydroxy-1-(thiophen-2-yl)pent-1-en-3-one

InChI: InChI=1S/C9H5F5O2S/c10-8(11,9(12,13)14)7(16)4-5(15)6-2-1-3-17-6/h1-4,15H

Composition: C (39.71%), H (1.85%), F (34.90%), O (11.76%), S (11.78%)

Molar Mass: 272.19

Atom Count: 22

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	271.99304139
Formal Charge	0
FSP3	0.22
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	QYFGIYDIXFXWJO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.07
Topological Polar Surface Area	37.3
Polarizability	18.14
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	1994-18-9		$187.20$187.20