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3,5-Difluoro-4-hydroxybenezenemethanol

CAT: 0572-TRC-D447290-750MGSize: 750 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D447290-750MGSize:750 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
206198-07-4
Hazard Statement
No Data Available
Smiles
OCc1cc(F)c(O)c(F)c1
Molecular Formula
C7 H6 F2 O2
Molecular Weight
160.118
InChI
InChI=1S/C7H6F2O2/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,10-11H,3H2
Additionnal Information
IUPAC name: 2,6-difluoro-4-(hydroxymethyl)phenol
Shipping Conditions
Room Temperature

Chemical Information

2,6-Difluoro-4-(hydroxymethyl)phenol
CAS Number206198-07-4
PubChem CID22011189
IUPAC Name2,6-difluoro-4-(hydroxymethyl)phenol
Molecular FormulaC7H6F2O2
Molecular Weight160.12
XLogP0.9
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity120
SMILES
C1=C(C=C(C(=C1F)O)F)CO
InChI
InChI=1S/C7H6F2O2/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,10-11H,3H2
InChIKey
GKBXKARGOXJKOD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,6-Difluoro-4-(hydroxymethyl)phenol
CAS: 206198-07-4
CID: 22011189
Formula: C7H6F2O2
MW: 160.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight160.12
XLogP30.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass160.03358575
Monoisotopic Mass160.03358575
Topological Polar Surface Area40.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity120
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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