[2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate
TL;DR: [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate (CAS 3186-27-4) is a chemical compound with molecular formula C9H18ClO5P and molecular weight 272.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate
Also Known As: 2-chloro-3-1-propenyldimethylphosphate
| Molecular Formula | C9H18ClO5P |
|---|---|
| Molecular Weight | 272.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 272.05804 |
| Heavy Atoms | 16 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 3186-27-4 |
|---|---|
| SMILES | CC(C)(C)OCC(=COP(=O)(OC)OC)Cl |
| InChIKey | GZYOOBPIOVWSJX-UHFFFAOYSA-N |
Product Overview
[2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate (CAS 3186-27-4), with molecular formula C9H18ClO5P and molecular weight 272.06 g/mol. IUPAC: [2-chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate.
Chemical Property Profile of [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate
Property Insights of [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate. With a topological polar surface area (TPSA) of 54.0 Ų, [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate has 0 hydrogen bond donor(s) and 5 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-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate?
The CAS number of [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate is 3186-27-4.
What is the molecular formula of [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate?
The molecular formula of [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate is C9H18ClO5P.
What is the molecular weight of [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate?
The molecular weight of [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate is 272.06 g/mol.
Where can I buy [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate?
You can request a quote for [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for [2-Chloro-3-[(2-methylpropan-2-yl)oxy]prop-1-enyl] dimethyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.