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Chemical structure of Supercinnamaldehyde

GC18827

Supercinnamaldehyde

Also known as (3Z)-1-methyl-3-(2-oxopropylidene)indol-2-one

Supercinnamaldehyde is an activator of the transient receptor potential ankyrin 1 (TRPA1) channel (EC50 = 0·8 uM) and an analog of cinnamaldehyde

ChemicalCAS70351-51-8MW201.2FormulaC12H11NO2
CAS number
70351-51-8
Molecular weight
201.2
Formula
C12H11NO2
Solubility
DMF: 20 mg/ml,DMSO: 20 mg/ml,DMSO:PBS(pH 7·2) (1:3): 0·25 mg/ml,Ethanol: 2 mg/ml
InChIKey
CZKBLHCEDVWPRN-YFHOEESVSA-N
Catalogue number
GC18827
Brand
GLPBIO
Computed properties PubChem CID 12480412 · XLogP 0.9 · TPSA 37.4 Ų · H-bond donors 0
XLogP
0.9
TPSA
37.4 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
15

SMILES CC(=O)/C=C\1/C2=CC=CC=C2N(C1=O)C

Computed descriptors from PubChem (CID 12480412), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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