2-Butene-1,4-diol
TL;DR: 2-Butene-1,4-diol (CAS 110-64-5) is a chemical compound with molecular formula C4H8O2 and molecular weight 88.05243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-2-ene-1,4-diol
Also Known As: 2-Butene-1,4-diol, Butenediol, but-2-ene-1,4-diol, Penitricin C, Agrisynth B2D
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H8O2 |
| Molecular Weight | 88.05243 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 88.05243 Da |
| Heavy Atoms | 6 |
| Complexity | 34.0 |
| Melting Point | 7 °C (45 °F) |
| Boiling Point | 141-149 °C AT 20 MM HG |
| Density | 1.067-1.074 |
| Flash Point | 128 °C |
| Vapor Pressure | 0.04 [mmHg] |
| Refractive Index | INDEX OF REFRACTION: 1.476-1.478 AT 25 °C/D |
| Solubility | VERY SOL IN WATER, ETHYL ALCOHOL, ACETONE; SPARINGLY SOL IN BENZENE |
| SMILES | C(C=CCO)O |
| InChIKey | ORTVZLZNOYNASJ-UHFFFAOYSA-N |
Product Description
Applications: 2-Butene-1,4-diol is used in polymer chemistry and functional materials synthesis, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Butene-1,4-diol (CAS 110-64-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
2-Butene-1,4-diol (CAS 110-64-5) is a polymer intermediate with the molecular formula C4H8O2 and a molecular weight of 88.05 g/mol. Key physical properties include a density of 1.067-1.074 g/cm³, a solubility: VERY SOL IN WATER, ETHYL ALCOHOL, ACETONE; SPARINGLY SOL IN BENZENE. It is also known as 2-Butene-1,4-diol and Butenediol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-Butene-1,4-diol
Property Insights of 2-Butene-1,4-diol
The XLogP value of -0.8 indicates that 2-Butene-1,4-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, 2-Butene-1,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butene-1,4-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Butene-1,4-diol?
The CAS number of 2-Butene-1,4-diol is 110-64-5.
What is the molecular formula of 2-Butene-1,4-diol?
The molecular formula of 2-Butene-1,4-diol is C4H8O2.
What is the molecular weight of 2-Butene-1,4-diol?
The molecular weight of 2-Butene-1,4-diol is 88.05243 g/mol.
What are the applications of 2-Butene-1,4-diol?
2-Butene-1,4-diol is used in polymer chemistry and functional materials synthesis, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Butene-1,4-diol (CAS 110-64-5) with...
Where can I buy 2-Butene-1,4-diol?
You can request a quote for 2-Butene-1,4-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Butene-1,4-diol?
Yes, CoreyChem provides custom synthesis services for 2-Butene-1,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.