![N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE structure](/static/products/7065/70650-82-7.webp)
N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE
TL;DR: N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE (CAS 70650-82-7) is a chemical compound with molecular formula C18H18Cl2F5N2O3P and molecular weight 506.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[bis(2-chloroethyl)amino-(2,3,4,5,6-pentafluorophenoxy)phosphoryl]-4-ethoxyaniline
Also Known As: N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE, N-[bis(2-chloroethyl)amino-(2,3,4,5,6-pentafluorophenoxy)phosphoryl]-4-ethoxyaniline, Pentafluorophenyl N,N-bis(2-chloroethyl)-N'-(4-ethoxyphenyl)phosphorodiamidate
| Molecular Formula | C18H18Cl2F5N2O3P |
|---|---|
| Molecular Weight | 506.04 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 506.03522 |
| Heavy Atoms | 31 |
| Complexity | 572.0 |
Chemical Identifiers
| CAS Number | 70650-82-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NP(=O)(N(CCCl)CCCl)OC2=C(C(=C(C(=C2F)F)F)F)F |
| InChIKey | HLOGKZJSTOMNQQ-UHFFFAOYSA-N |
Product Overview
N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE (CAS 70650-82-7), with molecular formula C18H18Cl2F5N2O3P and molecular weight 506.04 g/mol. IUPAC: N-[bis(2-chloroethyl)amino-(2,3,4,5,6-pentafluorophenoxy)phosphoryl]-4-ethoxyaniline.
Chemical Property Profile of N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE
Property Insights of N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE
The XLogP value of 5.4 indicates that N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE?
The CAS number of N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE is 70650-82-7.
What is the molecular formula of N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE?
The molecular formula of N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE is C18H18Cl2F5N2O3P.
What is the molecular weight of N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE?
The molecular weight of N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE is 506.04 g/mol.
Where can I buy N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE?
You can request a quote for N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE?
Yes, KEHONG BIO provides custom synthesis services for N-[BIS(2-CHLOROETHYL)AMINO-(2,3,4,5,6-PENTAFLUOROPHENOXY)PHOSPHORYL]-4-ETHOXY-ANILINE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.