![2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid structure](/static/products/2006/2006713-65-9.webp)
2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid
TL;DR: 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid (CAS 2006713-65-9) is a chemical compound with molecular formula C12H15Cl2NO3 and molecular weight 291.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid
Also Known As: 2-hydroxy-2-(4-methylnaphthalen-1-yl)acetic acid, 2-[4-[bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid, {4-[bis(2-chloroethyl)amino]phenyl}(hydroxy)acetic acid, 2-[4-[bis(2-chloroethyl)amino]phenyl]-2-hydroxy-acetic Acid
| Molecular Formula | C12H15Cl2NO3 |
|---|---|
| Molecular Weight | 291.04 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 60.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 291.0429 |
| Heavy Atoms | 18 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 2006713-65-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(C(=O)O)O)N(CCCl)CCCl |
| InChIKey | OGUOEXAPDGLKFQ-UHFFFAOYSA-N |
Product Overview
2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid (CAS 2006713-65-9), with molecular formula C12H15Cl2NO3 and molecular weight 291.04 g/mol. IUPAC: 2-[4-[bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid.
Chemical Property Profile of 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid
Property Insights of 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid. Following Lipinski's Rule of Five, 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid has 2 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-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid?
The CAS number of 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid is 2006713-65-9.
What is the molecular formula of 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid?
The molecular formula of 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid is C12H15Cl2NO3.
What is the molecular weight of 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid?
The molecular weight of 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid is 291.04 g/mol.
Where can I buy 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid?
You can request a quote for 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-[Bis(2-chloroethyl)amino]phenyl]-2-hydroxyacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.