(+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid
TL;DR: (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid (CAS 25514-64-1) is a chemical compound with molecular formula C13H18Cl2N2O2 and molecular weight 304.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-2-[2-[bis(2-chloroethyl)amino]phenyl]propanoic acid
Also Known As: Merophan, 2-{2-[Bis(2-chloroethyl)amino]phenyl}alanine, (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid, 2-amino-2-[2-[bis(2-chloroethyl)amino]phenyl]propanoic acid, Benzeneacetic acid, alpha-amino-2-(bis(2-chloroethyl)amino)-alpha-methyl-, (+-)-
| Molecular Formula | C13H18Cl2N2O2 |
|---|---|
| Molecular Weight | 304.07 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 304.07452 |
| Heavy Atoms | 19 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 25514-64-1 |
|---|---|
| SMILES | CC(C1=CC=CC=C1N(CCCl)CCCl)(C(=O)O)N |
| InChIKey | VVMBVXPZCYZOLQ-UHFFFAOYSA-N |
Product Overview
(+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid (CAS 25514-64-1), with molecular formula C13H18Cl2N2O2 and molecular weight 304.07 g/mol. IUPAC: 2-amino-2-[2-[bis(2-chloroethyl)amino]phenyl]propanoic acid.
Chemical Property Profile of (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid
Property Insights of (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid
The XLogP value of -0.2 indicates that (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid. Following Lipinski's Rule of Five, (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic 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 (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid?
The CAS number of (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid is 25514-64-1.
What is the molecular formula of (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid?
The molecular formula of (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid is C13H18Cl2N2O2.
What is the molecular weight of (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid?
The molecular weight of (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid is 304.07 g/mol.
Where can I buy (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid?
You can request a quote for (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid?
Yes, KEHONG BIO provides custom synthesis services for (+-)-alpha-Amino-2-(bis(2-chloroethyl)amino)-alpha-methylbenzeneacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.