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3,4-Dimethoxybenzaldehyde

CAT: 0024-sc-254534ASize: 100 gDry Ice: NoHazardous: No
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CAT#:0024-sc-254534ASize:100 g
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CAS Number
120-14-9

Chemical Information

Veratraldehyde

Veratraldehyde is a dimethoxybenzene that is benzaldehyde substituted by methoxy groups at positions 3 and 4. It is found in peppermint, ginger, raspberry, and other fruits. It has a role as an antifungal agent. It is a member of benzaldehydes and a dimethoxybenzene.

CAS Number120-14-9
PubChem CID8419
IUPAC Name3,4-dimethoxybenzaldehyde
Molecular FormulaC9H10O3
Molecular Weight166.17
XLogP1.5
Topological Polar Surface Area35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity147
SMILES
COC1=C(C=C(C=C1)C=O)OC
InChI
InChI=1S/C9H10O3/c1-11-8-4-3-7(6-10)5-9(8)12-2/h3-6H,1-2H3
InChIKey
WJUFSDZVCOTFON-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Veratraldehyde
CAS: 120-14-9
CID: 8419
Formula: C9H10O3
MW: 166.17
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight166.17
XLogP31.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass166.062994177
Monoisotopic Mass166.062994177
Topological Polar Surface Area35.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity147
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

Related Products

CatalogName
sc-3523834-Bromo-3,5-dimethoxybenzaldehyde
sc-2317623-Iodo-4,5-dimethoxybenzaldehyde
sc-3483194- (difluoromethoxy) -3,5-dimethoxybenzaldehyde
sc-2323614-Acetoxy-3,5-dimethoxybenzaldehyde
sc-2768304- (benzyloxy) -3,5-dimethoxybenzaldehyde
sc-2260203-Chloro-4,5-dimethoxybenzaldehyde
sc-352383A4-Bromo-3,5-dimethoxybenzaldehyde
sc-348319A4- (difluoromethoxy) -3,5-dimethoxybenzaldehyde
sc-3566193- (benzyloxy) -4,5-dimethoxybenzaldehyde
sc-356619A3- (benzyloxy) -4,5-dimethoxybenzaldehyde

Alternative Products

CatalogName
FD54842-013,4-Dimethoxybenzaldehyde
6040123,4‐DIMETHOXYBENZALDEHYDE
427125-013,4-Dimethoxybenzaldehyde-d6
1607713,4-Dimethoxybenzaldehyde-d3
C09212Veratraldehyde (3,4-Dimethoxybenzaldehyde)
OR11002493,4-Dimethoxybenzaldehyde oxime
14952127-013,4-Dimethoxybenzaldehyde (Veratraldehyde)

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