Phosphorous acid, cyclic o-phenylene-, isobutyl ester
TL;DR: Phosphorous acid, cyclic o-phenylene-, isobutyl ester (CAS 4591-39-3) is a chemical compound with molecular formula C10H13O3P and molecular weight 212.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylpropoxy)-1,3,2-benzodioxaphosphole
Also Known As: 2-isobutoxybenzo[d][1,3,2]dioxaphosphole, 2-(2-methylpropoxy)-1,3,2-benzodioxaphosphole, Phosphorous acid, cyclic o-phenylene-, isobutyl ester
| Molecular Formula | C10H13O3P |
|---|---|
| Molecular Weight | 212.06 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.06023 |
| Heavy Atoms | 14 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 4591-39-3 |
|---|---|
| SMILES | CC(C)COP1OC2=CC=CC=C2O1 |
| InChIKey | HZAUOUTUWDZSGV-UHFFFAOYSA-N |
Product Overview
Phosphorous acid, cyclic o-phenylene-, isobutyl ester (CAS 4591-39-3), with molecular formula C10H13O3P and molecular weight 212.06 g/mol. IUPAC: 2-(2-methylpropoxy)-1,3,2-benzodioxaphosphole.
Chemical Property Profile of Phosphorous acid, cyclic o-phenylene-, isobutyl ester
Property Insights of Phosphorous acid, cyclic o-phenylene-, isobutyl ester
The XLogP value of 3.1 indicates that Phosphorous acid, cyclic o-phenylene-, isobutyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, Phosphorous acid, cyclic o-phenylene-, isobutyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorous acid, cyclic o-phenylene-, isobutyl ester has 0 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 Phosphorous acid, cyclic o-phenylene-, isobutyl ester?
The CAS number of Phosphorous acid, cyclic o-phenylene-, isobutyl ester is 4591-39-3.
What is the molecular formula of Phosphorous acid, cyclic o-phenylene-, isobutyl ester?
The molecular formula of Phosphorous acid, cyclic o-phenylene-, isobutyl ester is C10H13O3P.
What is the molecular weight of Phosphorous acid, cyclic o-phenylene-, isobutyl ester?
The molecular weight of Phosphorous acid, cyclic o-phenylene-, isobutyl ester is 212.06 g/mol.
Where can I buy Phosphorous acid, cyclic o-phenylene-, isobutyl ester?
You can request a quote for Phosphorous acid, cyclic o-phenylene-, isobutyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorous acid, cyclic o-phenylene-, isobutyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorous acid, cyclic o-phenylene-, isobutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.