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4-fluoro-3-(trifluoromethyl)phenol

4-fluoro-3-(trifluoromethyl)phenol

CAS: 61721-07-1

Formula: C7H4F4O

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

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

InChI: InChI=1S/C7H4F4O/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3,12H

Composition: C (46.68%), H (2.24%), F (42.19%), O (8.88%)

Molar Mass: 180.102

Atom Count: 16

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 180.019827401
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey DHPCRFYUUWAGAH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.23
Topological Polar Surface Area 20.23
Polarizability 12.15
Ring Count 1
Rotatable Bond Count 1

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98% <5 Days 61721-07-1 $1,662.00$1,662.00
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