3-fluoro-4-(trifluoromethoxy)phenol

3-fluoro-4-(trifluoromethoxy)phenol

CAS: 177596-38-2

Formula: C7H4F4O2

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

IUPAC: 3-fluoro-4-(trifluoromethoxy)phenol

InChI: InChI=1S/C7H4F4O2/c8-5-3-4(12)1-2-6(5)13-7(9,10)11/h1-3,12H

Composition: C (42.87%), H (2.06%), F (38.75%), O (16.32%)

Molar Mass: 196.101

Atom Count: 17

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	196.014742021
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	UTFSPWRTXCDUIJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	31.33
Topological Polar Surface Area	29.46
Polarizability	12.97
Ring Count	1
Rotatable Bond Count	2

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