2-Chlorophenyl phosphoro-4-anisidochloridate
TL;DR: 2-Chlorophenyl phosphoro-4-anisidochloridate (CAS 82556-11-4) is a chemical compound with molecular formula C13H12Cl2NO3P and molecular weight 330.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[chloro-(2-chlorophenoxy)phosphoryl]-4-methoxyaniline
Also Known As: CPPAC, 2-Chlorophenyl phosphoro-4-anisidochloridate, 2-Chlorophenyl phosphoro-p-anisidochloridate, ortho-Chlorophenyl phosphoro-p-anisidochloridate, 2-CHLOROPHENYL PHOSPHORAMIDOCHLORIDATE
| Molecular Formula | C13H12Cl2NO3P |
|---|---|
| Molecular Weight | 330.99 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.9932 |
| Heavy Atoms | 20 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 82556-11-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NP(=O)(OC2=CC=CC=C2Cl)Cl |
| InChIKey | KCDQVKCQPQPGHO-UHFFFAOYSA-N |
Product Overview
2-Chlorophenyl phosphoro-4-anisidochloridate (CAS 82556-11-4), with molecular formula C13H12Cl2NO3P and molecular weight 330.99 g/mol. IUPAC: N-[chloro-(2-chlorophenoxy)phosphoryl]-4-methoxyaniline.
Chemical Property Profile of 2-Chlorophenyl phosphoro-4-anisidochloridate
Property Insights of 2-Chlorophenyl phosphoro-4-anisidochloridate
The XLogP value of 4.5 indicates that 2-Chlorophenyl phosphoro-4-anisidochloridate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 2-Chlorophenyl phosphoro-4-anisidochloridate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorophenyl phosphoro-4-anisidochloridate has 1 hydrogen bond donor(s) and 4 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-Chlorophenyl phosphoro-4-anisidochloridate?
The CAS number of 2-Chlorophenyl phosphoro-4-anisidochloridate is 82556-11-4.
What is the molecular formula of 2-Chlorophenyl phosphoro-4-anisidochloridate?
The molecular formula of 2-Chlorophenyl phosphoro-4-anisidochloridate is C13H12Cl2NO3P.
What is the molecular weight of 2-Chlorophenyl phosphoro-4-anisidochloridate?
The molecular weight of 2-Chlorophenyl phosphoro-4-anisidochloridate is 330.99 g/mol.
Where can I buy 2-Chlorophenyl phosphoro-4-anisidochloridate?
You can request a quote for 2-Chlorophenyl phosphoro-4-anisidochloridate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chlorophenyl phosphoro-4-anisidochloridate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorophenyl phosphoro-4-anisidochloridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.