Products for Research Use Only
RegisterLogin

Vanillin acetate

CAT: 0013-GTR19171287-01Size: 1 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19171287-01Size:1 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Vanillin acetate
CAS Number
881-68-5
Product Name Alternative
Vanillin acetate, Vanillin Acetate, Vanillin, Inhibitor, inhibit, anhydride, Acetylvanillin, acetic, Acetovanillin, 4-Acetoxy-3-methoxybenzaldehyde, 4-Formyl-2-methoxyphenyl Acetate, 4-Formyl-2-methoxyphenyl acetate
Purity
98.71% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (10.3 mM) ; DMSO:55 mg/mL (283.24 mM)
Smiles
COC1=CC (C=O) =CC=C1OC (C) =O
Molecular Formula
C10H10O4
Molecular Weight
194.18
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Vanillin acetate

Vanillin acetate is a phenyl acetate obtained by the formal condensation of phenolic group of vanillin with acetic acid. It is a member of phenyl acetates, a member of benzaldehydes and a monomethoxybenzene. It is functionally related to a vanillin.

CAS Number881-68-5
PubChem CID61229
IUPAC Name(4-formyl-2-methoxyphenyl) acetate
Molecular FormulaC10H10O4
Molecular Weight194.18
XLogP0.8
Topological Polar Surface Area52.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity214
SMILES
CC(=O)OC1=C(C=C(C=C1)C=O)OC
InChI
InChI=1S/C10H10O4/c1-7(12)14-9-4-3-8(6-11)5-10(9)13-2/h3-6H,1-2H3
InChIKey
PZSJOBKRSVRODF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Vanillin acetate
CAS: 881-68-5
CID: 61229
Formula: C10H10O4
MW: 194.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight194.18
XLogP30.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass194.05790880
Monoisotopic Mass194.05790880
Topological Polar Surface Area52.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity214
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
GTR19168144-01Vanillin
GTR19164289-01Vanillin
GTR19212531-01IMD-vanillin
GTR19164292-01Ethyl vanillin
GTR19222139-01Methyl acetate-PEG1-methyl acetate
GTR19175729-01Taltirelin acetate
GTR19277740-01(±) -Sabinyl acetate
GTR19203231-01Crizotinib acetate
GTR19248688-01Pentadecyl acetate
GTR19245390-01Tetramethylammonium acetate

Alternative Products

CatalogName
T2977-01Vanillin acetate
S9337-25mgEthyl vanillin acetate
HY-W009948R-01Vanillin acetate (Standard)
T6717-01Vanillin

Popular Products