2-ethyl-4,4,4-trifluoro-3-hydroxybutanoic acid

2-ethyl-4,4,4-trifluoro-3-hydroxybutanoic acid

CAS: 1260903-04-5

Formula: C6H9F3O3

SMILES: CCC(C(O)C(F)(F)F)C(O)=O

IUPAC: 2-ethyl-4,4,4-trifluoro-3-hydroxybutanoic acid

InChI: InChI=1/C6H9F3O3/c1-2-3(5(11)12)4(10)6(7,8)9/h3-4,10H,2H2,1H3,(H,11,12)

Composition: C (38.72%), H (4.87%), F (30.62%), O (25.79%)

Molar Mass: 186.13

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	186.050378639
Formal Charge	0
FSP3	0.83
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	DXEGAQLAECWJMO-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	33.34
Topological Polar Surface Area	57.53
Polarizability	12.75
Ring Count	0
Rotatable Bond Count	4

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95%	<5 Days	1260903-04-5		$554.00$554.00