3-Iodo-1,2-propanediol
TL;DR: 3-Iodo-1,2-propanediol (CAS 554-10-9) is a chemical compound with molecular formula C3H7IO2 and molecular weight 201.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-iodopropane-1,2-diol
Also Known As: Glyceryl iodide, 3-Iodopropane-1,2-diol, Alival, 3-Iodo-1,2-propanediol, alpha-iodohydrin
| Molecular Formula | C3H7IO2 |
|---|---|
| Molecular Weight | 201.95 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.94908 |
| Heavy Atoms | 6 |
| Complexity | 32.0 |
| Melting Point | 118 to 48.9 °C |
| Solubility | greater than or equal to 100 mg/mL at 63 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 554-10-9 |
|---|---|
| SMILES | C(C(CI)O)O |
| InChIKey | GLJRUXJFSCIQFV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Iodo-1,2-propanediol (CAS 554-10-9), with molecular formula C3H7IO2 and molecular weight 201.95 g/mol. IUPAC: 3-iodopropane-1,2-diol.
Chemical Property Profile of 3-Iodo-1,2-propanediol
Property Insights of 3-Iodo-1,2-propanediol
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Iodo-1,2-propanediol. With a topological polar surface area (TPSA) of 40.5 Ų, 3-Iodo-1,2-propanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Iodo-1,2-propanediol 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
Frequently Asked Questions
What is the CAS number of 3-Iodo-1,2-propanediol?
The CAS number of 3-Iodo-1,2-propanediol is 554-10-9.
What is the molecular formula of 3-Iodo-1,2-propanediol?
The molecular formula of 3-Iodo-1,2-propanediol is C3H7IO2.
What is the molecular weight of 3-Iodo-1,2-propanediol?
The molecular weight of 3-Iodo-1,2-propanediol is 201.95 g/mol.
Where can I buy 3-Iodo-1,2-propanediol?
You can request a quote for 3-Iodo-1,2-propanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Iodo-1,2-propanediol?
Yes, KEHONG BIO provides custom synthesis services for 3-Iodo-1,2-propanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.