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2,6-Dimethoxy-4-fluorobenzaldehyde

CAT: 0127-PC1010987Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
139549-11-4
MDL Number
MFCD12025137
Purity
97%
Smiles
C1c (cc (c (c1OC) C=O) OC) F

Chemical Information

4-Fluoro-2,6-dimethoxybenzaldehyde
CAS Number139549-11-4
PubChem CID15385138
IUPAC Name4-fluoro-2,6-dimethoxybenzaldehyde
Molecular FormulaC9H9FO3
Molecular Weight184.16
XLogP1.4
Topological Polar Surface Area35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity160
SMILES
COC1=CC(=CC(=C1C=O)OC)F
InChI
InChI=1S/C9H9FO3/c1-12-8-3-6(10)4-9(13-2)7(8)5-11/h3-5H,1-2H3
InChIKey
HOGUCRFULNNZBQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Fluoro-2,6-dimethoxybenzaldehyde
CAS: 139549-11-4
CID: 15385138
Formula: C9H9FO3
MW: 184.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight184.16
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass184.05357231
Monoisotopic Mass184.05357231
Topological Polar Surface Area35.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity160
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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Alternative Products

CatalogName
HTA62814-012,3-Dimethoxy-6-fluorobenzaldehyde
FD66932-012,6-Dimethyl-4-fluorobenzaldehyde
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sc-2738502- (4-Chlorophenoxy) -6-fluorobenzaldehyde
NQC95193-014-Bromo-2-ethoxy-6-fluorobenzaldehyde
EMB62133-014-Bromo-2-chloro-6-fluorobenzaldehyde
IHC990642-Bromo-6-chloro-4-fluorobenzaldehyde
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