Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL-
TL;DR: Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL- (CAS 2752-21-8) is a chemical compound with molecular formula C7H14Cl3NO2 and molecular weight 249.00902 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-carboxyethyl-bis(2-chloroethyl)azanium chloride
Also Known As: Alanine mustard, 1-carboxyethyl-bis azaniumchloride, N,N'-Bis(2-chloroethyl)alanine hydrochloride, AI3-50855, N,N-Bis(beta-chloroethyl) DL-alanine hydrochloride
Technical Specifications
| Molecular Formula | C7H14Cl3NO2 |
| Molecular Weight | 249.00902 g/mol |
| XLogP | -3.17 |
| Topological Polar Surface Area (TPSA) | 41.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 249.00902 Da |
| Heavy Atoms | 13 |
| Complexity | 137.0 |
| SMILES | CC(C(=O)O)[NH+](CCCl)CCCl.[Cl-] |
| InChIKey | OSFZRZNDOBDGPU-UHFFFAOYSA-N |
Chemical Property Profile of Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL-
Property Insights of Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL-
The XLogP value of -3.17 indicates that Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.7 Ų, Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL-?
The CAS number of Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL- is 2752-21-8.
What is the molecular formula of Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL-?
The molecular formula of Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL- is C7H14Cl3NO2.
What is the molecular weight of Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL-?
The molecular weight of Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL- is 249.00902 g/mol.
Where can I buy Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL-?
You can request a quote for Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL-?
Yes, CoreyChem provides custom synthesis services for Alanine, N,N-bis(2-chloroethyl)-, hydrochloride, DL- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.