![3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone structure](/static/products/5677/56771-83-6.webp)
3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone
TL;DR: 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone (CAS 56771-83-6) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(dimethylamino)prop-2-enylidene]-1-benzofuran-2-one
Also Known As: 3-[3-2-propenylidene]-2 -benzofuranone, 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 56771-83-6 |
|---|---|
| SMILES | CN(C)C=CC=C1C2=CC=CC=C2OC1=O |
| InChIKey | BPKSXTSMWQFXME-UHFFFAOYSA-N |
Product Overview
3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone (CAS 56771-83-6), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: 3-[3-(dimethylamino)prop-2-enylidene]-1-benzofuran-2-one.
Chemical Property Profile of 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone
Property Insights of 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone. With a topological polar surface area (TPSA) of 29.5 Ų, 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone?
The CAS number of 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone is 56771-83-6.
What is the molecular formula of 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone?
The molecular formula of 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone is C13H13NO2.
What is the molecular weight of 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone?
The molecular weight of 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone is 215.09 g/mol.
Where can I buy 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone?
You can request a quote for 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(Dimethylamino)-2-propenylidene]-2(3H)-benzofuranone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.