SML0317
Aldi-2
≥95% (HPLC)
Synonym(s):
3-(Dimethylamino)-1-(3-fluoro-4-methoxyphenyl)-1-propanone hydrochloride
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About This Item
Empirical Formula (Hill Notation):
C12H16FNO2
CAS Number:
Molecular Weight:
225.26
NACRES:
NA.77
PubChem Substance ID:
UNSPSC Code:
12352200
MDL number:
Quality Level
assay
≥95% (HPLC)
form
powder
storage condition
desiccated
color
white to beige
solubility
H2O: >5 mg/mL
storage temp.
2-8°C
SMILES string
COc1ccc(cc1F)C(=O)CCN(C)C
InChI
1S/C12H16FNO2/c1-14(2)7-6-11(15)9-4-5-12(16-3)10(13)8-9/h4-5,8H,6-7H2,1-3H3
InChI key
RNKMLXKYVDDHBX-UHFFFAOYSA-N
Biochem/physiol Actions
Aldi-2 is a potent and specific covalent inhibitor of aldehyde dehydrogenases.
Aldi-2 is a potent and specific covalent inhibitor of aldehyde dehydrogenases. Apparently, Aldi-2 undergoes an enzyme-mediated β-elimination which generates a vinyl-ketone intermediate that covalently modifies the active site cysteine.
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
Regulatory Information
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| SML0317-5MG | 04061832723396 |
| SML0317-25MG | 04061832723389 |