6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene
TL;DR: 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene (CAS 117902-88-2) is a chemical compound with molecular formula C16H18O3 and molecular weight 258.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene
Also Known As: 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene, Carbamic acid,diethyl-,2-quinolinyl ester, 6-methoxy-2,2,5-trimethyl-7-(prop-2-yn-1-yloxy)-2h-chromene, 6-methoxy-2,2,5-trimethyl-7-prop-2-ynoxy-chromene, 2H-1-Benzopyran,6-methoxy-2,2,5-trimethyl-7-(2-propyn-1-yloxy)-
| Molecular Formula | C16H18O3 |
|---|---|
| Molecular Weight | 258.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.12558 |
| Heavy Atoms | 19 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 117902-88-2 |
|---|---|
| SMILES | CC1=C2C=CC(OC2=CC(=C1OC)OCC#C)(C)C |
| InChIKey | BQVBBUMCYMCPKM-UHFFFAOYSA-N |
Product Overview
6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene (CAS 117902-88-2), with molecular formula C16H18O3 and molecular weight 258.13 g/mol. IUPAC: 6-methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene.
Chemical Property Profile of 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene
Property Insights of 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene
The XLogP value of 3.3 indicates that 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene 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 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene?
The CAS number of 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene is 117902-88-2.
What is the molecular formula of 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene?
The molecular formula of 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene is C16H18O3.
What is the molecular weight of 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene?
The molecular weight of 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene is 258.13 g/mol.
Where can I buy 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene?
You can request a quote for 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene?
Yes, KEHONG BIO provides custom synthesis services for 6-Methoxy-2,2,5-trimethyl-7-prop-2-ynoxychromene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.