1,2-Propanediol, 2-acetate
TL;DR: 1,2-Propanediol, 2-acetate (CAS 6214-01-3) is a chemical compound with molecular formula C5H10O3 and molecular weight 118.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxypropan-2-yl acetate
Also Known As: 1,2-Propanediol, 2-acetate, 1-hydroxypropan-2-yl acetate, 2-Acetoxy-1-propanol, propylene glycol-2-acetate, Propylene glycol 2-acetate
| Molecular Formula | C5H10O3 |
|---|---|
| Molecular Weight | 118.06 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 118.062996 |
| Heavy Atoms | 8 |
| Complexity | 79.0 |
Chemical Identifiers
| CAS Number | 6214-01-3 |
|---|---|
| SMILES | CC(CO)OC(=O)C |
| InChIKey | YJNKLTDJZSXVHQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Propanediol, 2-acetate (CAS 6214-01-3), with molecular formula C5H10O3 and molecular weight 118.06 g/mol. IUPAC: 1-hydroxypropan-2-yl acetate.
Chemical Property Profile of 1,2-Propanediol, 2-acetate
Property Insights of 1,2-Propanediol, 2-acetate
The XLogP value of -0.1 indicates that 1,2-Propanediol, 2-acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, 1,2-Propanediol, 2-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Propanediol, 2-acetate has 1 hydrogen bond donor(s) and 3 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, 2-acetate?
The CAS number of 1,2-Propanediol, 2-acetate is 6214-01-3.
What is the molecular formula of 1,2-Propanediol, 2-acetate?
The molecular formula of 1,2-Propanediol, 2-acetate is C5H10O3.
What is the molecular weight of 1,2-Propanediol, 2-acetate?
The molecular weight of 1,2-Propanediol, 2-acetate is 118.06 g/mol.
Where can I buy 1,2-Propanediol, 2-acetate?
You can request a quote for 1,2-Propanediol, 2-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, 2-acetate?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediol, 2-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.