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4-(hydroxymethyl)-2-(trifluoromethyl)phenol

4-(hydroxymethyl)-2-(trifluoromethyl)phenol

CAS: 773871-37-7

Formula: C8H7F3O2

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

IUPAC: 4-(hydroxymethyl)-2-(trifluoromethyl)phenol

InChI: InChI=1S/C8H7F3O2/c9-8(10,11)6-3-5(4-12)1-2-7(6)13/h1-3,12-13H,4H2

Composition: C (50.01%), H (3.67%), F (29.66%), O (16.65%)

Molar Mass: 192.137

Atom Count: 20

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 192.039813954
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey YAVKPKJJZUIHAS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.83
Topological Polar Surface Area 40.46
Polarizability 14.71
Ring Count 1
Rotatable Bond Count 2

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95% <5 Days 773871-37-7 $2,420.00-$6,000.00$2,420.00$6,000.00
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