2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl-
TL;DR: 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl- (CAS 94244-79-8) is a chemical compound with molecular formula C14H18O3 and molecular weight 234.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-ethoxy-5-methoxy-2,2-dimethylchromene
Also Known As: 7-ethoxy-5-methoxy-2,2-dimethylchromene, 7-ethoxy-5-methoxy-2,2-dimethyl-chromene, 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl-, 7-Ethoxy-5-methoxy-2,2-dimethyl-2H-1-benzopyran
| Molecular Formula | C14H18O3 |
|---|---|
| Molecular Weight | 234.13 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.1256 |
| Heavy Atoms | 17 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 94244-79-8 |
|---|---|
| SMILES | CCOC1=CC2=C(C=CC(O2)(C)C)C(=C1)OC |
| InChIKey | AJJBCQFDAQIEJV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl- (CAS 94244-79-8), with molecular formula C14H18O3 and molecular weight 234.13 g/mol. IUPAC: 7-ethoxy-5-methoxy-2,2-dimethylchromene.
Chemical Property Profile of 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl-
Property Insights of 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl-
The XLogP value of 3.2 indicates that 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl- 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 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl-?
The CAS number of 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl- is 94244-79-8.
What is the molecular formula of 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl-?
The molecular formula of 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl- is C14H18O3.
What is the molecular weight of 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl-?
The molecular weight of 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl- is 234.13 g/mol.
Where can I buy 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl-?
You can request a quote for 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran, 7-ethoxy-5-methoxy-2,2-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.