Dehydrotremetone
TL;DR: Dehydrotremetone (CAS 3015-20-1) is a chemical compound with molecular formula C13H12O2 and molecular weight 200.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-prop-1-en-2-yl-1-benzofuran-5-yl)ethanone
Also Known As: DEHYDROTREMETONE, MEGxp0_001563, 5-Acetyl-2-isopropenylbenzofuran, 1-(2-prop-1-en-2-yl-1-benzofuran-5-yl)ethanone, 1-(2-isopropenylbenzofuran-5-yl)ethanone
| Molecular Formula | C13H12O2 |
|---|---|
| Molecular Weight | 200.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.08372 |
| Heavy Atoms | 15 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 3015-20-1 |
|---|---|
| SMILES | CC(=C)C1=CC2=C(O1)C=CC(=C2)C(=O)C |
| InChIKey | DMYZBECNVZSNRN-UHFFFAOYSA-N |
Product Overview
Dehydrotremetone (CAS 3015-20-1), with molecular formula C13H12O2 and molecular weight 200.08 g/mol. IUPAC: 1-(2-prop-1-en-2-yl-1-benzofuran-5-yl)ethanone.
Chemical Property Profile of Dehydrotremetone
Property Insights of Dehydrotremetone
The XLogP value of 3.4 indicates that Dehydrotremetone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.2 Ų, Dehydrotremetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dehydrotremetone has 0 hydrogen bond donor(s) and 2 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 Dehydrotremetone?
The CAS number of Dehydrotremetone is 3015-20-1.
What is the molecular formula of Dehydrotremetone?
The molecular formula of Dehydrotremetone is C13H12O2.
What is the molecular weight of Dehydrotremetone?
The molecular weight of Dehydrotremetone is 200.08 g/mol.
Where can I buy Dehydrotremetone?
You can request a quote for Dehydrotremetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dehydrotremetone?
Yes, KEHONG BIO provides custom synthesis services for Dehydrotremetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.