4-hydroxy-2-(trifluoromethoxy)benzaldehyde

4-hydroxy-2-(trifluoromethoxy)benzaldehyde

CAS: 1017083-37-2

Formula: C8H5F3O3

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

IUPAC: 4-hydroxy-2-(trifluoromethoxy)benzaldehyde

InChI: InChI=1S/C8H5F3O3/c9-8(10,11)14-7-3-6(13)2-1-5(7)4-12/h1-4,13H

Composition: C (46.62%), H (2.45%), F (27.65%), O (23.29%)

Molar Mass: 206.12

Atom Count: 19

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	206.01907851
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	HPHHSFUXCMITFI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.69
Topological Polar Surface Area	46.53
Polarizability	14.99
Ring Count	1
Rotatable Bond Count	3

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