2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester
TL;DR: 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester (CAS 55919-77-2) is a chemical compound with molecular formula C8H14O5 and molecular weight 190.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-hydroxy-2,2-bis(hydroxymethyl)propyl] prop-2-enoate
Also Known As: pentaerythritol acrylate, pentaerythritol monoacrylate, Pentaerythritolmonoacrylate, 3-Hydroxy-2,2-bis(hydroxymethyl)propyl acrylate, [3-hydroxy-2,2-bis(hydroxymethyl)propyl] prop-2-enoate
| Molecular Formula | C8H14O5 |
|---|---|
| Molecular Weight | 190.08 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 190.08412 |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 55919-77-2 |
|---|---|
| SMILES | C=CC(=O)OCC(CO)(CO)CO |
| InChIKey | ZCZFEIZSYJAXKS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester (CAS 55919-77-2), with molecular formula C8H14O5 and molecular weight 190.08 g/mol. IUPAC: [3-hydroxy-2,2-bis(hydroxymethyl)propyl] prop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester
Property Insights of 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester
The XLogP value of -1.0 indicates that 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester. Following Lipinski's Rule of Five, 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester 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 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester?
The CAS number of 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester is 55919-77-2.
What is the molecular formula of 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester?
The molecular formula of 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester is C8H14O5.
What is the molecular weight of 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester?
The molecular weight of 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester is 190.08 g/mol.
Where can I buy 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester?
You can request a quote for 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester 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, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 3-hydroxy-2,2-bis(hydroxymethyl)propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.