alpha-(Dihydroxyphosphinylmethyl)acrylic acid
TL;DR: alpha-(Dihydroxyphosphinylmethyl)acrylic acid (CAS 4538-02-7) is a chemical compound with molecular formula C4H7O5P and molecular weight 166.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(phosphonomethyl)prop-2-enoic acid
Also Known As: alpha-(Dihydroxyphosphinylmethyl)acrylic acid, 2-(phosphonomethyl)prop-2-enoic acid, (E)-2-Methyl-3-Phosphonoacrylate, 2-Propenoic acid, 2-(phosphonomethyl)-, 2-(PHOSPHONOMETHYL)ACRYLIC ACID
| Molecular Formula | C4H7O5P |
|---|---|
| Molecular Weight | 166.00 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.00311 |
| Heavy Atoms | 10 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 4538-02-7 |
|---|---|
| SMILES | C=C(CP(=O)(O)O)C(=O)O |
| InChIKey | CVMBCYJJZICNKP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-(Dihydroxyphosphinylmethyl)acrylic acid (CAS 4538-02-7), with molecular formula C4H7O5P and molecular weight 166.00 g/mol. IUPAC: 2-(phosphonomethyl)prop-2-enoic acid.
Chemical Property Profile of alpha-(Dihydroxyphosphinylmethyl)acrylic acid
Property Insights of alpha-(Dihydroxyphosphinylmethyl)acrylic acid
The XLogP value of -1.6 indicates that alpha-(Dihydroxyphosphinylmethyl)acrylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-(Dihydroxyphosphinylmethyl)acrylic acid. Following Lipinski's Rule of Five, alpha-(Dihydroxyphosphinylmethyl)acrylic acid has 3 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 alpha-(Dihydroxyphosphinylmethyl)acrylic acid?
The CAS number of alpha-(Dihydroxyphosphinylmethyl)acrylic acid is 4538-02-7.
What is the molecular formula of alpha-(Dihydroxyphosphinylmethyl)acrylic acid?
The molecular formula of alpha-(Dihydroxyphosphinylmethyl)acrylic acid is C4H7O5P.
What is the molecular weight of alpha-(Dihydroxyphosphinylmethyl)acrylic acid?
The molecular weight of alpha-(Dihydroxyphosphinylmethyl)acrylic acid is 166.00 g/mol.
Where can I buy alpha-(Dihydroxyphosphinylmethyl)acrylic acid?
You can request a quote for alpha-(Dihydroxyphosphinylmethyl)acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-(Dihydroxyphosphinylmethyl)acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for alpha-(Dihydroxyphosphinylmethyl)acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.