2-(Phosphonooxy)but-2-enoic acid
TL;DR: 2-(Phosphonooxy)but-2-enoic acid (CAS 31302-64-4) is a chemical compound with molecular formula C4H7O6P and molecular weight 182.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phosphonooxybut-2-enoic acid
Also Known As: 2-phosphonooxybut-2-enoic acid, 2-(Phosphonooxy)but-2-enoic acid, 2-Butenoic acid, 2-(phosphonooxy)-, 2-Butenoic acid, 2-(phosphonooxy)-, (Z)-
| Molecular Formula | C4H7O6P |
|---|---|
| Molecular Weight | 182.00 g/mol |
| LogP | 0.0841 |
| Topological Polar Surface Area | 104.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 181.99803 |
| Heavy Atoms | 11 |
| Complexity | 224.73679 |
Chemical Identifiers
| CAS Number | 31302-64-4 |
|---|---|
| SMILES | CC=C(C(=O)O)OP(=O)(O)O |
Product Overview
2-(Phosphonooxy)but-2-enoic acid (CAS 31302-64-4), with molecular formula C4H7O6P and molecular weight 182.00 g/mol. IUPAC: 2-phosphonooxybut-2-enoic acid.
Chemical Property Profile of 2-(Phosphonooxy)but-2-enoic acid
Property Insights of 2-(Phosphonooxy)but-2-enoic acid
The XLogP value of 0.0841 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Phosphonooxy)but-2-enoic acid. The TPSA of 104.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Phosphonooxy)but-2-enoic acid. Following Lipinski's Rule of Five, 2-(Phosphonooxy)but-2-enoic acid has 3 hydrogen bond donor(s) and 3 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-(Phosphonooxy)but-2-enoic acid?
The CAS number of 2-(Phosphonooxy)but-2-enoic acid is 31302-64-4.
What is the molecular formula of 2-(Phosphonooxy)but-2-enoic acid?
The molecular formula of 2-(Phosphonooxy)but-2-enoic acid is C4H7O6P.
What is the molecular weight of 2-(Phosphonooxy)but-2-enoic acid?
The molecular weight of 2-(Phosphonooxy)but-2-enoic acid is 182.00 g/mol.
Where can I buy 2-(Phosphonooxy)but-2-enoic acid?
You can request a quote for 2-(Phosphonooxy)but-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Phosphonooxy)but-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Phosphonooxy)but-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.