N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1)
TL;DR: N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1) (CAS 66903-12-6) is a chemical compound with molecular formula C12H19Cl2N and molecular weight 247.08946 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloroethyl-ethyl-(1-phenylethyl)azanium chloride
Also Known As: N-(2-Chloroethyl)-N-ethyl-alpha-methylbenzylamine hydrochloride, 2-chloroethyl-ethyl-(1-phenylethyl)azanium chloride, BENZYLAMINE, N-(2-CHLOROETHYL)-N-ETHYL-alpha-METHYL-, HYDROCHLORIDE, N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1), Benzenemethanamine, N-(2-chloroethyl)-N-ethyl-.alpha.-methyl-, hydrochloride
Technical Specifications
| Molecular Formula | C12H19Cl2N |
| Molecular Weight | 247.08946 g/mol |
| XLogP | -1.1 |
| Topological Polar Surface Area (TPSA) | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 247.08946 Da |
| Heavy Atoms | 15 |
| Complexity | 143.0 |
| SMILES | CC[NH+](CCCl)C(C)C1=CC=CC=C1.[Cl-] |
| InChIKey | WHMNVTVGPNXCCI-UHFFFAOYSA-N |
Chemical Property Profile of N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1)
Property Insights of N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1)
The XLogP value of -1.1 indicates that N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 4.4 Ų, N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1) has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1)?
The CAS number of N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1) is 66903-12-6.
What is the molecular formula of N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1)?
The molecular formula of N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1) is C12H19Cl2N.
What is the molecular weight of N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1)?
The molecular weight of N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1) is 247.08946 g/mol.
Where can I buy N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1)?
You can request a quote for N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1)?
Yes, CoreyChem provides custom synthesis services for N-(2-Chloroethyl)-N-ethyl-1-phenylethan-1-amine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.