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2-[4-fluoro-3-(trifluoromethyl)phenyl]propan-2-ol

2-[4-fluoro-3-(trifluoromethyl)phenyl]propan-2-ol

CAS: 534-39-4

Formula: C10H10F4O

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

IUPAC: 2-[4-fluoro-3-(trifluoromethyl)phenyl]propan-2-ol

InChI: InChI=1S/C10H10F4O/c1-9(2,15)6-3-4-8(11)7(5-6)10(12,13)14/h3-5,15H,1-2H3

Composition: C (54.06%), H (4.54%), F (34.20%), O (7.20%)

Molar Mass: 222.183

Atom Count: 25

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 222.066777594
Formal Charge 0
FSP3 0.4
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey QQNITPNLHMKSLF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.12
Topological Polar Surface Area 20.23
Polarizability 17.45
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <14 Days 534-39-4 $94.50-$354.38$94.50$354.38
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95% <2 Days 534-39-4 $96.26-$336.89$96.26$336.89
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