C9H11Cl2O3P
TL;DR: C9H11Cl2O3P (CAS 83656-27-3) is a chemical compound with molecular formula C9H11Cl2O3P and molecular weight 267.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dichloro-2-[propa-1,2-dienyl(prop-2-ynoxy)phosphoryl]oxypropane
Also Known As: Phosphonic acid, 1,2-propadienyl-, 2-chloro-1-(chloromethyl)ethyl 2-propynyl ester, 1,3-dichloro-2-[propa-1,2-dienyl(prop-2-ynoxy)phosphoryl]oxypropane, 1,3-dichloropropan-2-yl prop-2-yn-1-yl propadienylphosphonate, 1,2-PROPADIENYLPHOSPHONIC ACID 2-CHLORO-1-(CHLOROMETHYL)ETHYL 2-PROPYNYL ESTER
| Molecular Formula | C9H11Cl2O3P |
|---|---|
| Molecular Weight | 267.98 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 267.9823 |
| Heavy Atoms | 15 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 83656-27-3 |
|---|---|
| SMILES | C=C=CP(=O)(OCC#C)OC(CCl)CCl |
| InChIKey | ZOWHDSWYGHQUPD-UHFFFAOYSA-N |
Product Overview
C9H11Cl2O3P (CAS 83656-27-3), with molecular formula C9H11Cl2O3P and molecular weight 267.98 g/mol. IUPAC: 1,3-dichloro-2-[propa-1,2-dienyl(prop-2-ynoxy)phosphoryl]oxypropane.
Chemical Property Profile of C9H11Cl2O3P
Property Insights of C9H11Cl2O3P
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C9H11Cl2O3P. With a topological polar surface area (TPSA) of 35.5 Ų, C9H11Cl2O3P exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C9H11Cl2O3P 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 C9H11Cl2O3P?
The CAS number of C9H11Cl2O3P is 83656-27-3.
What is the molecular formula of C9H11Cl2O3P?
The molecular formula of C9H11Cl2O3P is C9H11Cl2O3P.
What is the molecular weight of C9H11Cl2O3P?
The molecular weight of C9H11Cl2O3P is 267.98 g/mol.
Where can I buy C9H11Cl2O3P?
You can request a quote for C9H11Cl2O3P directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C9H11Cl2O3P?
Yes, KEHONG BIO provides custom synthesis services for C9H11Cl2O3P and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.