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3-Fluoro-5- (hydroxymethyl) phenol

CAT: 0926-KAC76216-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-KAC76216-01Size:50 mg
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CAS Number
1260762-16-0
MDL Number
MFCD16249597
Smiles
C1=C (C=C (C=C1O) F) CO
Molecular Formula
C7H7FO2
Molecular Weight
142.13 g/mol
Controlled
No

Chemical Information

3-Fluoro-5-(hydroxymethyl)phenol
CAS Number1260762-16-0
PubChem CID112692783
IUPAC Name3-fluoro-5-(hydroxymethyl)phenol
Molecular FormulaC7H7FO2
Molecular Weight142.13
XLogP0.8
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity108
SMILES
C1=C(C=C(C=C1O)F)CO
InChI
InChI=1S/C7H7FO2/c8-6-1-5(4-9)2-7(10)3-6/h1-3,9-10H,4H2
InChIKey
GSCWZZPSUZGTMV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Fluoro-5-(hydroxymethyl)phenol
CAS: 1260762-16-0
CID: 112692783
Formula: C7H7FO2
MW: 142.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight142.13
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass142.04300762
Monoisotopic Mass142.04300762
Topological Polar Surface Area40.5 Ų
Heavy Atom Count10
Formal Charge0
Complexity108
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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