C19H21ClO5
TL;DR: C19H21ClO5 (CAS 577694-69-0) is a chemical compound with molecular formula C19H21ClO5 and molecular weight 364.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[7-(2-chloroprop-2-enoxy)-4,8-dimethyl-2-oxochromen-3-yl]propanoate
Also Known As: EiM07-28341, ethyl 3-{7-[(2-chloroprop-2-en-1-yl)oxy]-4,8-dimethyl-2-oxo-2H-chromen-3-yl}propanoate, ethyl 3-(7-((2-chloroallyl)oxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoate, ethyl 3-[7-(2-chloroprop-2-enoxy)-4,8-dimethyl-2-oxochromen-3-yl]propanoate
| Molecular Formula | C19H21ClO5 |
|---|---|
| Molecular Weight | 364.11 g/mol |
| LogP | 4.03684 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 364.10776 |
| Heavy Atoms | 25 |
| Complexity | 866.224 |
Chemical Identifiers
| CAS Number | 577694-69-0 |
|---|---|
| SMILES | CCOC(=O)CCC1=C(C2=C(C(=C(C=C2)OCC(=C)Cl)C)OC1=O)C |
Product Overview
C19H21ClO5 (CAS 577694-69-0), with molecular formula C19H21ClO5 and molecular weight 364.11 g/mol. IUPAC: ethyl 3-[7-(2-chloroprop-2-enoxy)-4,8-dimethyl-2-oxochromen-3-yl]propanoate.
Chemical Property Profile of C19H21ClO5
Property Insights of C19H21ClO5
The XLogP value of 4.03684 indicates that C19H21ClO5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for C19H21ClO5. Following Lipinski's Rule of Five, C19H21ClO5 has 0 hydrogen bond donor(s) and 5 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 C19H21ClO5?
The CAS number of C19H21ClO5 is 577694-69-0.
What is the molecular formula of C19H21ClO5?
The molecular formula of C19H21ClO5 is C19H21ClO5.
What is the molecular weight of C19H21ClO5?
The molecular weight of C19H21ClO5 is 364.11 g/mol.
Where can I buy C19H21ClO5?
You can request a quote for C19H21ClO5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19H21ClO5?
Yes, KEHONG BIO provides custom synthesis services for C19H21ClO5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.