(3,4-Dimethyl-2-oxochromen-7-yl) propanoate
TL;DR: (3,4-Dimethyl-2-oxochromen-7-yl) propanoate (CAS 370583-50-9) is a chemical compound with molecular formula C14H14O4 and molecular weight 246.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dimethyl-2-oxochromen-7-yl) propanoate
Also Known As: (3,4-dimethyl-2-oxochromen-7-yl) propanoate, 3,4-dimethyl-2-oxo-2H-chromen-7-yl propionate, 3,4-dimethyl-2-oxo-2H-chromen-7-yl propanoate
| Molecular Formula | C14H14O4 |
|---|---|
| Molecular Weight | 246.09 g/mol |
| LogP | 2.72524 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.0892 |
| Heavy Atoms | 18 |
| Complexity | 667.2837 |
Chemical Identifiers
| CAS Number | 370583-50-9 |
|---|---|
| SMILES | CCC(=O)OC1=CC2=C(C=C1)C(=C(C(=O)O2)C)C |
Product Overview
(3,4-Dimethyl-2-oxochromen-7-yl) propanoate (CAS 370583-50-9), with molecular formula C14H14O4 and molecular weight 246.09 g/mol. IUPAC: (3,4-dimethyl-2-oxochromen-7-yl) propanoate.
Chemical Property Profile of (3,4-Dimethyl-2-oxochromen-7-yl) propanoate
Property Insights of (3,4-Dimethyl-2-oxochromen-7-yl) propanoate
The XLogP value of 2.72524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,4-Dimethyl-2-oxochromen-7-yl) propanoate. With a topological polar surface area (TPSA) of 56.51 Ų, (3,4-Dimethyl-2-oxochromen-7-yl) propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,4-Dimethyl-2-oxochromen-7-yl) propanoate has 0 hydrogen bond donor(s) and 4 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 (3,4-Dimethyl-2-oxochromen-7-yl) propanoate?
The CAS number of (3,4-Dimethyl-2-oxochromen-7-yl) propanoate is 370583-50-9.
What is the molecular formula of (3,4-Dimethyl-2-oxochromen-7-yl) propanoate?
The molecular formula of (3,4-Dimethyl-2-oxochromen-7-yl) propanoate is C14H14O4.
What is the molecular weight of (3,4-Dimethyl-2-oxochromen-7-yl) propanoate?
The molecular weight of (3,4-Dimethyl-2-oxochromen-7-yl) propanoate is 246.09 g/mol.
Where can I buy (3,4-Dimethyl-2-oxochromen-7-yl) propanoate?
You can request a quote for (3,4-Dimethyl-2-oxochromen-7-yl) propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-Dimethyl-2-oxochromen-7-yl) propanoate?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Dimethyl-2-oxochromen-7-yl) propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.