3-chloro-1,1,1-trifluoro-4-(4-fluorophenyl)-4-hydroxybut-3-en-2-one

3-chloro-1,1,1-trifluoro-4-(4-fluorophenyl)-4-hydroxybut-3-en-2-one

CAS: 886494-03-7

Formula: C10H5ClF4O2

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

IUPAC: 3-chloro-1,1,1-trifluoro-4-(4-fluorophenyl)-4-hydroxybut-3-en-2-one

InChI: InChI=1S/C10H5ClF4O2/c11-7(9(17)10(13,14)15)8(16)5-1-3-6(12)4-2-5/h1-4,16H

Composition: C (44.72%), H (1.88%), Cl (13.20%), F (28.29%), O (11.91%)

Molar Mass: 268.59

Atom Count: 22

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	267.9914198
Formal Charge	0
FSP3	0.1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	XLDUEXDNRCQUQP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.52
Topological Polar Surface Area	37.3
Polarizability	19.41
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	886494-03-7		$254.80$254.80