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[2,3-difluoro-4-(trifluoromethyl)phenyl]methanol

[2,3-difluoro-4-(trifluoromethyl)phenyl]methanol

CAS: 238403-50-4

Formula: C8H5F5O

SMILES: OCC1=C(F)C(F)=C(C=C1)C(F)(F)F

IUPAC: [2,3-difluoro-4-(trifluoromethyl)phenyl]methanol

InChI: InChI=1S/C8H5F5O/c9-6-4(3-14)1-2-5(7(6)10)8(11,12)13/h1-2,14H,3H2

Composition: C (45.30%), H (2.38%), F (44.78%), O (7.54%)

Molar Mass: 212.119

Atom Count: 19

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 212.026055596
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey YDHLVDCBIBCSPA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 39.28
Topological Polar Surface Area 20.23
Polarizability 13.87
Ring Count 1
Rotatable Bond Count 2

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95% <2 Days 238403-50-4 $51.35-$86.31$51.35$63.37$86.31
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