3-Phenylmethoxybutane-1,2,4-triol
TL;DR: 3-Phenylmethoxybutane-1,2,4-triol (CAS 84379-52-2) is a chemical compound with molecular formula C11H16O4 and molecular weight 212.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylmethoxybutane-1,2,4-triol
Also Known As: 3-phenylmethoxybutane-1,2,4-triol, 2-o-benzyl-D-threitol, (+)-2-O-Benzyl-L-threitol, 2-benzyloxy 1,3,4-butanetriol, Butane-1,2,4-triol, 3-benzyloxy-
| Molecular Formula | C11H16O4 |
|---|---|
| Molecular Weight | 212.10 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 212.10486 |
| Heavy Atoms | 15 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 84379-52-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(CO)C(CO)O |
| InChIKey | YYGZBCNOJHZTGA-UHFFFAOYSA-N |
Product Overview
3-Phenylmethoxybutane-1,2,4-triol (CAS 84379-52-2), with molecular formula C11H16O4 and molecular weight 212.10 g/mol. IUPAC: 3-phenylmethoxybutane-1,2,4-triol.
Chemical Property Profile of 3-Phenylmethoxybutane-1,2,4-triol
Property Insights of 3-Phenylmethoxybutane-1,2,4-triol
The XLogP value of -0.3 indicates that 3-Phenylmethoxybutane-1,2,4-triol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Phenylmethoxybutane-1,2,4-triol. Following Lipinski's Rule of Five, 3-Phenylmethoxybutane-1,2,4-triol has 3 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 3-Phenylmethoxybutane-1,2,4-triol?
The CAS number of 3-Phenylmethoxybutane-1,2,4-triol is 84379-52-2.
What is the molecular formula of 3-Phenylmethoxybutane-1,2,4-triol?
The molecular formula of 3-Phenylmethoxybutane-1,2,4-triol is C11H16O4.
What is the molecular weight of 3-Phenylmethoxybutane-1,2,4-triol?
The molecular weight of 3-Phenylmethoxybutane-1,2,4-triol is 212.10 g/mol.
Where can I buy 3-Phenylmethoxybutane-1,2,4-triol?
You can request a quote for 3-Phenylmethoxybutane-1,2,4-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenylmethoxybutane-1,2,4-triol?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenylmethoxybutane-1,2,4-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.