3′,4′-(Methylenedioxy)propiophenone
- CAS NO.：28281-49-4
- Empirical Formula: C10H10O3
- Molecular Weight: 178.18
- MDL number: MFCD00016652
- EINECS: 248-937-6
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-09-24 16:40:18
What is 3′,4′-(Methylenedioxy)propiophenone?
Description
3′,4′-(Methylenedioxy)propiophenone, also known as 3,4-(Methylenedioxy)phenyl-1-propanone (MDP1P), is a member of the benzodioxole family, which is a five-membered heterocyclic compound. This compound is a phenylpropanoid found in some plants of the genus Piper and is an isomer of 3,4-methylenedioxyphenyl-2-propanone (MDP2P).
Chemical properties
Pale Orange Solid
The Uses of 3′,4′-(Methylenedioxy)propiophenone
Intermediate in the production of Isosafrole and Ethylone.
Definition
ChEBI: 3,4-Methylenedioxypropiophenone is a member of benzodioxoles.
What are the applications of Application
3′,4′-(Methylenedioxy)propiophenone is a synthetic compound with a fatty acid chain. It has been shown to have potent activity against leishmania and has been used as an intermediate in the synthesis of other drugs. 3′,4′-(Methylenedioxy)propiophenone can be synthesized by acylation reactions with chloride and acetylcholinesterase inhibition. This product also has molecular docking properties, which have been analyzed using computational methods, such as profiling and profile analysis.
Synthesis Reference(s)
Tetrahedron Letters, 23, p. 3085, 1982 DOI: 10.1016/S0040-4039(00)87539-5
Properties of 3′,4′-(Methylenedioxy)propiophenone
| Melting point: | 34-36°C |
| Boiling point: | 165-168°C 20mm |
| Density | 1,21 g/cm3 |
| Flash point: | 165-168°C/20mm |
| solubility | Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly) |
| form | Low-Melting Solid |
| color | Off-White to Light Brown |
| BRN | 165729 |
| InChI | InChI=1S/C10H10O3/c1-2-8(11)7-3-4-9-10(5-7)13-6-12-9/h3-5H,2,6H2,1H3 |
| CAS DataBase Reference | 28281-49-4(CAS DataBase Reference) |
Safety information for 3′,4′-(Methylenedioxy)propiophenone
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Environment GHS09 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation H411:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P233:Keep container tightly closed. P260:Do not breathe dust/fume/gas/mist/vapours/spray. P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P271:Use only outdoors or in a well-ventilated area. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P304:IF INHALED: P312:Call a POISON CENTER or doctor/physician if you feel unwell. P321:Specific treatment (see … on this label). P330:Rinse mouth. P340:Remove victim to fresh air and keep at rest in a position comfortable for breathing. P362:Take off contaminated clothing and wash before reuse. P391:Collect spillage. Hazardous to the aquatic environment P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P302+P352:IF ON SKIN: wash with plenty of soap and water. P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P332+P313:IF SKIN irritation occurs: Get medical advice/attention. P337+P313:IF eye irritation persists: Get medical advice/attention. P403:Store in a well-ventilated place. P405:Store locked up. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P501:Dispose of contents/container to..… |
Computed Descriptors for 3′,4′-(Methylenedioxy)propiophenone
| InChIKey | RVBJGSPBFIUTTR-UHFFFAOYSA-N |
| SMILES | C(C1=CC=C2OCOC2=C1)(=O)CC |
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product: 3,4-Methylenedioxy propiophenone 98%
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