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Asaraldehyde

CAT: 0013-GTR19171601-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19171601-01Size:5 g
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Description
Asaraldehyde
CAS Number
4460-86-0
Product Name Alternative
Inhibitor, inhibit, Cyclooxygenase, COX-2, COX, Asaraldehyde, Asaronaldehyde, Asarylaldehyde, 2,4,5-trimethoxy-Benzaldehyde
Field of Research
Immunology & Inflammation, Neuroscience
Purity
99.72% (May vary between batches)
Solubility
H2O:< 1 mg/mL (insoluble or slightly soluble) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2.00 mg/mL (10.19 mM) ; Ethanol:16.00 mg/mL (81.55 mM) ; DMSO:50.00 mg/mL (254.84 mM)
Smiles
COC1=CC (OC) =C (C=O) C=C1OC
Molecular Formula
C10H12O4
Molecular Weight
196.20
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2,4,5-Trimethoxybenzaldehyde

2,4,5-trimethoxybenzaldehyde is a carbonyl compound.

CAS Number4460-86-0
PubChem CID20525
IUPAC Name2,4,5-trimethoxybenzaldehyde
Molecular FormulaC10H12O4
Molecular Weight196.20
XLogP1.3
Topological Polar Surface Area44.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity183
SMILES
COC1=CC(=C(C=C1C=O)OC)OC
InChI
InChI=1S/C10H12O4/c1-12-8-5-10(14-3)9(13-2)4-7(8)6-11/h4-6H,1-3H3
InChIKey
IAJBQAYHSQIQRE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,4,5-Trimethoxybenzaldehyde
CAS: 4460-86-0
CID: 20525
Formula: C10H12O4
MW: 196.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight196.20
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass196.07355886
Monoisotopic Mass196.07355886
Topological Polar Surface Area44.8 Ų
Heavy Atom Count14
Formal Charge0
Complexity183
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
GTR19159476-01Asarylaldehyde

Alternative Products

CatalogName
B1456-100Asaraldehyde
E1KS2531Asaraldehyde (Asaronaldehyde)
HY-100580R-01Asaraldehyde (Standard)
A10090-5000Asaraldehyde (Asaronaldehyde) 5g
A10090-1000Asaraldehyde (Asaronaldehyde) 1g
A10090-10mM-DAsaraldehyde 10mM * 1mL in DMSO

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