1,2-Propanediol, 3-((p-benzyloxy)phenoxy)-
TL;DR: 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)- (CAS 53446-74-5) is a chemical compound with molecular formula C16H18O4 and molecular weight 274.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-phenylmethoxyphenoxy)propane-1,2-diol
Also Known As: 3-(p-Benzyloxyphenoxy)-1,2-propanediol, 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)-, 3-(4-phenylmethoxyphenoxy)propane-1,2-diol, 3-[4-(benzyloxy)phenoxy]propane-1,2-diol, 1,2-Propanediol, 3-(4-(phenylmethoxy)phenoxy)-
| Molecular Formula | C16H18O4 |
|---|---|
| Molecular Weight | 274.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 274.1205 |
| Heavy Atoms | 20 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 53446-74-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)OCC(CO)O |
| InChIKey | CLZPEXPWVLNWBT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Propanediol, 3-((p-benzyloxy)phenoxy)- (CAS 53446-74-5), with molecular formula C16H18O4 and molecular weight 274.12 g/mol. IUPAC: 3-(4-phenylmethoxyphenoxy)propane-1,2-diol.
Chemical Property Profile of 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)-
Property Insights of 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)-. With a topological polar surface area (TPSA) of 58.9 Ų, 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)- 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 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)-?
The CAS number of 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)- is 53446-74-5.
What is the molecular formula of 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)-?
The molecular formula of 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)- is C16H18O4.
What is the molecular weight of 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)-?
The molecular weight of 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)- is 274.12 g/mol.
Where can I buy 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)-?
You can request a quote for 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediol, 3-((p-benzyloxy)phenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.