1,2-Propanediol, 3-phenoxy-, 1-acetate
TL;DR: 1,2-Propanediol, 3-phenoxy-, 1-acetate (CAS 63715-95-7) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxy-3-phenoxypropyl) acetate
Also Known As: 2-hydroxy-3-phenoxypropyl acetate, 3-Phenoxy-1,2-propanediol 1-acetate, 1-Acetyloxy-3-phenoxy-2-propanol, 1-Phenyl-ether-3-acetate glycerol, 1-Acetoxy-3-phenoxy-2-propanol
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 63715-95-7 |
|---|---|
| SMILES | CC(=O)OCC(COC1=CC=CC=C1)O |
| InChIKey | DQUIGLNWFFUKSE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Propanediol, 3-phenoxy-, 1-acetate (CAS 63715-95-7), with molecular formula C11H14O4 and molecular weight 210.09 g/mol. IUPAC: (2-hydroxy-3-phenoxypropyl) acetate.
Chemical Property Profile of 1,2-Propanediol, 3-phenoxy-, 1-acetate
Property Insights of 1,2-Propanediol, 3-phenoxy-, 1-acetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Propanediol, 3-phenoxy-, 1-acetate. With a topological polar surface area (TPSA) of 55.8 Ų, 1,2-Propanediol, 3-phenoxy-, 1-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Propanediol, 3-phenoxy-, 1-acetate has 1 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-phenoxy-, 1-acetate?
The CAS number of 1,2-Propanediol, 3-phenoxy-, 1-acetate is 63715-95-7.
What is the molecular formula of 1,2-Propanediol, 3-phenoxy-, 1-acetate?
The molecular formula of 1,2-Propanediol, 3-phenoxy-, 1-acetate is C11H14O4.
What is the molecular weight of 1,2-Propanediol, 3-phenoxy-, 1-acetate?
The molecular weight of 1,2-Propanediol, 3-phenoxy-, 1-acetate is 210.09 g/mol.
Where can I buy 1,2-Propanediol, 3-phenoxy-, 1-acetate?
You can request a quote for 1,2-Propanediol, 3-phenoxy-, 1-acetate 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-phenoxy-, 1-acetate?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediol, 3-phenoxy-, 1-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.