2,3-Oxiranedimethanol
TL;DR: 2,3-Oxiranedimethanol (CAS 4440-87-3) is a chemical compound with molecular formula C4H8O3 and molecular weight 104.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(hydroxymethyl)oxiran-2-yl]methanol
Also Known As: 2,3-Oxiranedimethanol, Oxirane-2,3-dimethanol, [3-(hydroxymethyl)oxiran-2-yl]methanol, Oxirane-2,3-bismethanol, Gadobutrol Impurity 121
| Molecular Formula | C4H8O3 |
|---|---|
| Molecular Weight | 104.05 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 104.04734 |
| Heavy Atoms | 7 |
| Complexity | 56.0 |
Chemical Identifiers
| CAS Number | 4440-87-3 |
|---|---|
| SMILES | C(C1C(O1)CO)O |
| InChIKey | PENWRXZLRDTNBI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Oxiranedimethanol (CAS 4440-87-3), with molecular formula C4H8O3 and molecular weight 104.05 g/mol. IUPAC: [3-(hydroxymethyl)oxiran-2-yl]methanol.
Chemical Property Profile of 2,3-Oxiranedimethanol
Property Insights of 2,3-Oxiranedimethanol
The XLogP value of -1.4 indicates that 2,3-Oxiranedimethanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.0 Ų, 2,3-Oxiranedimethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Oxiranedimethanol has 2 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 2,3-Oxiranedimethanol?
The CAS number of 2,3-Oxiranedimethanol is 4440-87-3.
What is the molecular formula of 2,3-Oxiranedimethanol?
The molecular formula of 2,3-Oxiranedimethanol is C4H8O3.
What is the molecular weight of 2,3-Oxiranedimethanol?
The molecular weight of 2,3-Oxiranedimethanol is 104.05 g/mol.
Where can I buy 2,3-Oxiranedimethanol?
You can request a quote for 2,3-Oxiranedimethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Oxiranedimethanol?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Oxiranedimethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.