2-(3,4-dichlorophenyl)-3,3,3-trifluoro-2-hydroxypropanoic acid

2-(3,4-dichlorophenyl)-3,3,3-trifluoro-2-hydroxypropanoic acid

Formula: C9H5Cl2F3O3

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

IUPAC: 2-(3,4-dichlorophenyl)-3,3,3-trifluoro-2-hydroxypropanoic acid

InChI: InChI=1/C9H5Cl2F3O3/c10-5-2-1-4(3-6(5)11)8(17,7(15)16)9(12,13)14/h1-3,17H,(H,15,16)

Composition: C (37.40%), H (1.74%), Cl (24.53%), F (19.72%), O (16.61%)

Molar Mass: 289.03

Atom Count: 22

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	287.9567839
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	QNEJIPULAWNNJF-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.73
Topological Polar Surface Area	57.53
Polarizability	20.62
Ring Count	1
Rotatable Bond Count	3

Suppliers

Kinentia Biosciences LLC

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<14 Days	C9H5Cl2F3O3		$340.20$340.20