2-Fluoro-3,6-dimethoxybenzaldehyde

CAT: 0926-IGB34233-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0926-IGB34233-01Size:250 mg

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CAS Number

783342-33-6

MDL Number

MFCD19439911

Smiles

COC1=C (C (=C (C=C1) OC) F) C=O

Molecular Formula

C9H9FO3

Molecular Weight

184.16 g/mol

Controlled

Chemical Information

2-Fluoro-3,6-dimethoxybenzaldehyde

CAS Number	783342-33-6
PubChem CID	10583615
IUPAC Name	2-fluoro-3,6-dimethoxybenzaldehyde
Molecular Formula	C9H9FO3
Molecular Weight	184.16
XLogP	1.4
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	174

SMILES

COC1=C(C(=C(C=C1)OC)F)C=O

InChI

InChI=1S/C9H9FO3/c1-12-7-3-4-8(13-2)9(10)6(7)5-11/h3-5H,1-2H3

InChIKey

LNPHQRXMWZSAHH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 783342-33-6

CID: 10583615

Formula: C9H9FO3

MW: 184.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	184.16
XLogP3	1.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	184.05357231
Monoisotopic Mass	184.05357231
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	174
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FD70156-01	2,6-Dimethoxybenzaldehyde
EBA86651-01	3-Bromo-2,6-dimethoxybenzaldehyde
DCA81150-01	6-Bromo-2,3-dimethoxybenzaldehyde
WCA92461-01	3-Fluoro-4,5-Dimethoxybenzaldehyde
FD10645-01	2,3-Dimethoxybenzaldehyde
FGA83146-01	5-Fluoro-2,4-dimethoxybenzaldehyde
HDA47761	2-Chloro-4,6-dimethoxybenzaldehyde
GDA57469	2-Bromo-4,6-dimethoxybenzaldehyde
EEC05038-01	4-Bromo-2,6-dimethoxybenzaldehyde
WCA29521	5-Bromo-2,3-dimethoxybenzaldehyde

Catalog	Name
PC1010175	3-Fluoro-2,6-dimethoxybenzaldehyde
PC100333-01	6-Fluoro-2,3-dimethoxybenzaldehyde
PC1024034-01	3-Bromo-2-fluoro-5,6-dimethoxybenzaldehyde
PC1012900-01	6-Bromo-2-fluoro-3,4-dimethoxybenzaldehyde
PC1017414-01	2-Fluoro-3-iodo-5,6-dimethoxybenzaldehyde
PC1009026-01	2-Fluoro-3,5-dimethoxybenzaldehyde
PC1010716	4-Fluoro-2,3-dimethoxybenzaldehyde
PC1001875-01	2-Fluoro-3,4-dimethoxybenzaldehyde
HY-W001249-01	2,6-Dimethoxybenzaldehyde
OR1093993-01	3-hydroxy-2,6-dimethoxybenzaldehyde