Phosphinic acid, allylmethyl-, isopropyl ester
TL;DR: Phosphinic acid, allylmethyl-, isopropyl ester (CAS 6225-86-1) is a chemical compound with molecular formula C7H15O2P and molecular weight 162.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[methyl(prop-2-enyl)phosphoryl]oxypropane
Also Known As: Isopropyl allylmethylphosphinate, Phosphinic acid, allylmethyl-, isopropyl ester, 2-[methyl(prop-2-enyl)phosphoryl]oxypropane, Phosphinic acid, methyl-2-propenyl-, 1-methylethyl ester, propan-2-yl methyl(prop-2-en-1-yl)phosphinate
| Molecular Formula | C7H15O2P |
|---|---|
| Molecular Weight | 162.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 162.08096 |
| Heavy Atoms | 10 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 6225-86-1 |
|---|---|
| SMILES | CC(C)OP(=O)(C)CC=C |
| InChIKey | DNRQKVJZKCHGRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphinic acid, allylmethyl-, isopropyl ester (CAS 6225-86-1), with molecular formula C7H15O2P and molecular weight 162.08 g/mol. IUPAC: 2-[methyl(prop-2-enyl)phosphoryl]oxypropane.
Chemical Property Profile of Phosphinic acid, allylmethyl-, isopropyl ester
Property Insights of Phosphinic acid, allylmethyl-, isopropyl ester
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphinic acid, allylmethyl-, isopropyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Phosphinic acid, allylmethyl-, isopropyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphinic acid, allylmethyl-, isopropyl ester has 0 hydrogen bond donor(s) and 2 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 Phosphinic acid, allylmethyl-, isopropyl ester?
The CAS number of Phosphinic acid, allylmethyl-, isopropyl ester is 6225-86-1.
What is the molecular formula of Phosphinic acid, allylmethyl-, isopropyl ester?
The molecular formula of Phosphinic acid, allylmethyl-, isopropyl ester is C7H15O2P.
What is the molecular weight of Phosphinic acid, allylmethyl-, isopropyl ester?
The molecular weight of Phosphinic acid, allylmethyl-, isopropyl ester is 162.08 g/mol.
Where can I buy Phosphinic acid, allylmethyl-, isopropyl ester?
You can request a quote for Phosphinic acid, allylmethyl-, isopropyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphinic acid, allylmethyl-, isopropyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphinic acid, allylmethyl-, isopropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.