2-(trifluoromethoxy)benzaldehyde

2-(trifluoromethoxy)benzaldehyde

CAS: 94651-33-9

Formula: C8H5F3O2

SMILES: FC(F)(F)OC1=CC=CC=C1C=O

IUPAC: 2-(trifluoromethoxy)benzaldehyde

InChI: InChI=1S/C8H5F3O2/c9-8(10,11)13-7-4-2-1-3-6(7)5-12/h1-5H

Composition: C (50.54%), H (2.65%), F (29.98%), O (16.83%)

Molar Mass: 190.121

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	190.02416389
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	CPHXLFKIUVVIOQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	35.71
Topological Polar Surface Area	26.3
Polarizability	14.26
Ring Count	1
Rotatable Bond Count	3

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