4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid
TL;DR: 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid (CAS 148-78-7) is a chemical compound with molecular formula C18H18Cl2N2O4 and molecular weight 396.06436 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]benzoic acid
Also Known As: IC 140, I.C. 140, I.C.140, N-(p-(Bis(2-chloroethyl)amino)phenyl) p-carboxycarbanilate, 4-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]benzoic acid
Technical Specifications
| Molecular Formula | C18H18Cl2N2O4 |
| Molecular Weight | 396.06436 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 396.06436 Da |
| Heavy Atoms | 26 |
| Complexity | 444.0 |
| SMILES | C1=CC(=CC=C1C(=O)O)NC(=O)OC2=CC=C(C=C2)N(CCCl)CCCl |
| InChIKey | CNLVZUPSGAAHAO-UHFFFAOYSA-N |
Product Description
Applications: 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid is a fine chemical identified by CAS number 148-78-7 and the molecular formula C18H18Cl2N2O4 and a molecular weight of 396.06 g/mol. Synonyms include IC 140 and IC-140.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid
Property Insights of 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid
The XLogP value of 3.9 indicates that 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid. Following Lipinski's Rule of Five, 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid?
The CAS number of 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid is 148-78-7.
What is the molecular formula of 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid?
The molecular formula of 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid is C18H18Cl2N2O4.
What is the molecular weight of 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid?
The molecular weight of 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid is 396.06436 g/mol.
What are the applications of 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid?
4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full...
Where can I buy 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid?
You can request a quote for 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 4-(((4-(Bis(2-chloroethyl)amino)phenoxy)carbonyl)amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.