2-[4-(trifluoromethyl)phenoxy]propanoic acid

2-[4-(trifluoromethyl)phenoxy]propanoic acid

CAS: 69484-34-0

Formula: C10H9F3O3

SMILES: CC(OC1=CC=C(C=C1)C(F)(F)F)C(O)=O

IUPAC: 2-[4-(trifluoromethyl)phenoxy]propanoic acid

InChI: InChI=1/C10H9F3O3/c1-6(9(14)15)16-8-4-2-7(3-5-8)10(11,12)13/h2-6H,1H3,(H,14,15)

Composition: C (51.29%), H (3.87%), F (24.34%), O (20.50%)

Molar Mass: 234.174

Atom Count: 25

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	234.050378639
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZZCGVEYHZSLNKD-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.07
Topological Polar Surface Area	46.53
Polarizability	18.4
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	69484-34-0		$109.71-$682.07$109.71$431.60$682.07