2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)-
TL;DR: 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)- (CAS 3993-43-9) is a chemical compound with molecular formula C14H14O3 and molecular weight 230.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,8-dimethyl-7-prop-2-enoxychromen-2-one
Also Known As: 7-Allyloxy-4,8-dimethylcoumarin, Coumarin,8-dimethyl-, 7-(Allyloxy)-4,8-dimethyl-2H-chromen-2-one, 7-allyloxy-4,8-dimethyl-chromen-2-one, Coumarin, 7-(allyloxy)-4,8-dimethyl-
| Molecular Formula | C14H14O3 |
|---|---|
| Molecular Weight | 230.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.0943 |
| Heavy Atoms | 17 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 3993-43-9 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2C)OCC=C |
| InChIKey | CWBNOQSQEHMTNZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)- (CAS 3993-43-9), with molecular formula C14H14O3 and molecular weight 230.09 g/mol. IUPAC: 4,8-dimethyl-7-prop-2-enoxychromen-2-one.
Chemical Property Profile of 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)-
Property Insights of 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)-. With a topological polar surface area (TPSA) of 35.5 Ų, 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)- 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-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)-?
The CAS number of 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)- is 3993-43-9.
What is the molecular formula of 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)-?
The molecular formula of 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)- is C14H14O3.
What is the molecular weight of 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)-?
The molecular weight of 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)- is 230.09 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)-?
You can request a quote for 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)- 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-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-2-one, 4,8-dimethyl-7-(2-propen-1-yloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.