methyl 4-hydroxy-2-(trifluoromethyl)benzoate

methyl 4-hydroxy-2-(trifluoromethyl)benzoate

Formula: C9H7F3O3

SMILES: COC(=O)C1=C(C=C(O)C=C1)C(F)(F)F

IUPAC: methyl 4-hydroxy-2-(trifluoromethyl)benzoate

InChI: InChI=1S/C9H7F3O3/c1-15-8(14)6-3-2-5(13)4-7(6)9(10,11)12/h2-4,13H,1H3

Composition: C (49.10%), H (3.21%), F (25.89%), O (21.80%)

Molar Mass: 220.147

Atom Count: 22

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	220.034728574
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	OLSWKTCQCZAEOW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.04
Topological Polar Surface Area	46.53
Polarizability	16.75
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C9H7F3O3		Quote Only