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(4-[ (2-Fluorophenyl) methoxy]phenyl) methanol

CAT: 0926-QCB96348-01Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-QCB96348-01Size:0.5 g
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CAS Number
690963-48-5
MDL Number
MFCD03715937
Smiles
C1=CC=C (C (=C1) COC2=CC=C (C=C2) CO) F
Molecular Formula
C14H13FO2
Molecular Weight
232.25 g/mol
Controlled
No

Chemical Information

(4-[(2-Fluorophenyl)methoxy]phenyl)methanol
CAS Number690963-48-5
PubChem CID896337
IUPAC Name[4-[(2-fluorophenyl)methoxy]phenyl]methanol
Molecular FormulaC14H13FO2
Molecular Weight232.25
XLogP2.8
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count17
Formal Charge0
Complexity214
SMILES
C1=CC=C(C(=C1)COC2=CC=C(C=C2)CO)F
InChI
InChI=1S/C14H13FO2/c15-14-4-2-1-3-12(14)10-17-13-7-5-11(9-16)6-8-13/h1-8,16H,9-10H2
InChIKey
GEPCVUQQSDLTEN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (4-[(2-Fluorophenyl)methoxy]phenyl)methanol
CAS: 690963-48-5
CID: 896337
Formula: C14H13FO2
MW: 232.25
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight232.25
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass232.08995782
Monoisotopic Mass232.08995782
Topological Polar Surface Area29.5 Ų
Heavy Atom Count17
Formal Charge0
Complexity214
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