2,2-Difluoropropane-1,3-diol
TL;DR: 2,2-Difluoropropane-1,3-diol (CAS 428-63-7) is a chemical compound with molecular formula C3H6F2O2 and molecular weight 112.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-difluoropropane-1,3-diol
Also Known As: 2,2-difluoropropane-1,3-diol, 2,2-DIFLUORO-1,3-PROPANEDIOL, 1,3-Propanediol, 2,2-difluoro-, 2,2-Difluoropropane-1,3-diol 50g, 807-402-2
| Molecular Formula | C3H6F2O2 |
|---|---|
| Molecular Weight | 112.03 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 112.033585 |
| Heavy Atoms | 7 |
| Complexity | 48.0 |
Chemical Identifiers
| CAS Number | 428-63-7 |
|---|---|
| SMILES | C(C(CO)(F)F)O |
| InChIKey | AMCKYDINHDOOCB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Difluoropropane-1,3-diol (CAS 428-63-7), with molecular formula C3H6F2O2 and molecular weight 112.03 g/mol. IUPAC: 2,2-difluoropropane-1,3-diol.
Chemical Property Profile of 2,2-Difluoropropane-1,3-diol
Property Insights of 2,2-Difluoropropane-1,3-diol
The XLogP value of -0.5 indicates that 2,2-Difluoropropane-1,3-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, 2,2-Difluoropropane-1,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Difluoropropane-1,3-diol has 2 hydrogen bond donor(s) and 4 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 2,2-Difluoropropane-1,3-diol?
The CAS number of 2,2-Difluoropropane-1,3-diol is 428-63-7.
What is the molecular formula of 2,2-Difluoropropane-1,3-diol?
The molecular formula of 2,2-Difluoropropane-1,3-diol is C3H6F2O2.
What is the molecular weight of 2,2-Difluoropropane-1,3-diol?
The molecular weight of 2,2-Difluoropropane-1,3-diol is 112.03 g/mol.
Where can I buy 2,2-Difluoropropane-1,3-diol?
You can request a quote for 2,2-Difluoropropane-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Difluoropropane-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Difluoropropane-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.