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[5- (Dimethoxymethyl) -2-fluorophenyl]methanol

CAT: 0926-JNA01916-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-JNA01916-01Size:50 mg
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CAS Number
334019-16-8
MDL Number
MFCD28397387
Smiles
COC (C1=CC (=C (C=C1) F) CO) OC
Molecular Formula
C10H13FO3
Molecular Weight
200.21 g/mol
Controlled
No

Chemical Information

[5-(Dimethoxymethyl)-2-fluorophenyl]methanol
CAS Number334019-16-8
PubChem CID69802218
IUPAC Name[5-(dimethoxymethyl)-2-fluorophenyl]methanol
Molecular FormulaC10H13FO3
Molecular Weight200.21
XLogP0.8
Topological Polar Surface Area38.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity161
SMILES
COC(C1=CC(=C(C=C1)F)CO)OC
InChI
InChI=1S/C10H13FO3/c1-13-10(14-2)7-3-4-9(11)8(5-7)6-12/h3-5,10,12H,6H2,1-2H3
InChIKey
WUXAYONXWVPKME-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of [5-(Dimethoxymethyl)-2-fluorophenyl]methanol
CAS: 334019-16-8
CID: 69802218
Formula: C10H13FO3
MW: 200.21
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight200.21
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass200.08487243
Monoisotopic Mass200.08487243
Topological Polar Surface Area38.7 Ų
Heavy Atom Count14
Formal Charge0
Complexity161
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