2-Propenoic acid, 2-(phosphonooxy)-, ion(1-)
TL;DR: 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-) (CAS 76975-15-0) is a chemical compound with molecular formula C3H4O6P- and molecular weight 166.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phosphonooxyprop-2-enoate
Also Known As: phosphoenolpyruvate, 2-(Phosphonooxy)acrylate, P-enol-pyruvate, P-enol-pyr, Phosphoenylpyruvate
| Molecular Formula | C3H4O6P- |
|---|---|
| Molecular Weight | 166.97 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.97455 |
| Heavy Atoms | 10 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 76975-15-0 |
|---|---|
| SMILES | C=C(C(=O)[O-])OP(=O)(O)O |
| InChIKey | DTBNBXWJWCWCIK-UHFFFAOYSA-M |
Product Overview
2-Propenoic acid, 2-(phosphonooxy)-, ion(1-) (CAS 76975-15-0), with molecular formula C3H4O6P- and molecular weight 166.97 g/mol. IUPAC: 2-phosphonooxyprop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-)
Property Insights of 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-)
The XLogP value of -1.2 indicates that 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-). Following Lipinski's Rule of Five, 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-) has 2 hydrogen bond donor(s) and 6 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 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-)?
The CAS number of 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-) is 76975-15-0.
What is the molecular formula of 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-)?
The molecular formula of 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-) is C3H4O6P-.
What is the molecular weight of 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-)?
The molecular weight of 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-) is 166.97 g/mol.
Where can I buy 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-)?
You can request a quote for 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-)?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.