Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-
TL;DR: Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)- (CAS 72304-76-8) is a chemical compound with molecular formula C12H15O7P and molecular weight 302.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-dimethoxyphosphorylcarbonyloxyphenyl)propanoic acid
Also Known As: Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-, 3-(4-dimethoxyphosphorylcarbonyloxyphenyl)propanoic acid, Benzenepropanoic acid, 4-[[(dimethoxyphosphinyl)carbonyl]oxy]-, 3-(4-{[(DIMETHOXYPHOSPHORYL)CARBONYL]OXY}PHENYL)PROPANOIC ACID
| Molecular Formula | C12H15O7P |
|---|---|
| Molecular Weight | 302.06 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 302.05554 |
| Heavy Atoms | 20 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 72304-76-8 |
|---|---|
| SMILES | COP(=O)(C(=O)OC1=CC=C(C=C1)CCC(=O)O)OC |
| InChIKey | FOHANEWYENYFFG-UHFFFAOYSA-N |
Product Overview
Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)- (CAS 72304-76-8), with molecular formula C12H15O7P and molecular weight 302.06 g/mol. IUPAC: 3-(4-dimethoxyphosphorylcarbonyloxyphenyl)propanoic acid.
Chemical Property Profile of Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-
Property Insights of Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-. Following Lipinski's Rule of Five, Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)- has 1 hydrogen bond donor(s) and 7 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 Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-?
The CAS number of Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)- is 72304-76-8.
What is the molecular formula of Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-?
The molecular formula of Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)- is C12H15O7P.
What is the molecular weight of Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-?
The molecular weight of Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)- is 302.06 g/mol.
Where can I buy Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-?
You can request a quote for Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenepropanoic acid, 4-(((dimethoxyphosphinyl)carbonyl)oxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.