2-Hydroxypropyl heptanoate
TL;DR: 2-Hydroxypropyl heptanoate (CAS 7249-54-9) is a chemical compound with molecular formula C10H20O3 and molecular weight 188.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxypropyl heptanoate
Also Known As: 2-Hydroxypropyl heptanoate, Propylene glycol heptanoate, 2-hydroxypropylheptanoate, CAPMUL 907P, Heptanoic acid,2-hydroxypropyl ester
| Molecular Formula | C10H20O3 |
|---|---|
| Molecular Weight | 188.14 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 188.14125 |
| Heavy Atoms | 13 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 7249-54-9 |
|---|---|
| SMILES | CCCCCCC(=O)OCC(C)O |
| InChIKey | DZOOROWXIIPFGA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hydroxypropyl heptanoate (CAS 7249-54-9), with molecular formula C10H20O3 and molecular weight 188.14 g/mol. IUPAC: 2-hydroxypropyl heptanoate.
Chemical Property Profile of 2-Hydroxypropyl heptanoate
Property Insights of 2-Hydroxypropyl heptanoate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxypropyl heptanoate. With a topological polar surface area (TPSA) of 46.5 Ų, 2-Hydroxypropyl heptanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxypropyl heptanoate 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 2-Hydroxypropyl heptanoate?
The CAS number of 2-Hydroxypropyl heptanoate is 7249-54-9.
What is the molecular formula of 2-Hydroxypropyl heptanoate?
The molecular formula of 2-Hydroxypropyl heptanoate is C10H20O3.
What is the molecular weight of 2-Hydroxypropyl heptanoate?
The molecular weight of 2-Hydroxypropyl heptanoate is 188.14 g/mol.
Where can I buy 2-Hydroxypropyl heptanoate?
You can request a quote for 2-Hydroxypropyl heptanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxypropyl heptanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxypropyl heptanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.