N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1)
TL;DR: N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1) (CAS 99862-88-1) is a chemical compound with molecular formula C10H22Cl3N and molecular weight 261.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-chloroethyl)-hexylazanium chloride
Also Known As: N,N-Bis(2-chloroethyl)-1-hexylamine hydrochloride, bis(2-chloroethyl)-hexylazanium chloride, 1-HEXYLAMINE, N,N-BIS(2-CHLOROETHYL)-, HYDROCHLORIDE, N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1), RefChem:1090384
| Molecular Formula | C10H22Cl3N |
|---|---|
| Molecular Weight | 261.08 g/mol |
| LogP | -1.07 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 261.0818 |
| Heavy Atoms | 14 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 99862-88-1 |
|---|---|
| SMILES | CCCCCC[NH+](CCCl)CCCl.[Cl-] |
| InChIKey | PEEJGSDACNRYIE-UHFFFAOYSA-N |
Product Overview
N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1) (CAS 99862-88-1), with molecular formula C10H22Cl3N and molecular weight 261.08 g/mol. IUPAC: bis(2-chloroethyl)-hexylazanium chloride.
Chemical Property Profile of N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1)
Property Insights of N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1)
The XLogP value of -1.07 indicates that N,N-Bis(2-chloroethyl)hexan-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,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Bis(2-chloroethyl)hexan-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
Frequently Asked Questions
What is the CAS number of N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1)?
The CAS number of N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1) is 99862-88-1.
What is the molecular formula of N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1)?
The molecular formula of N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1) is C10H22Cl3N.
What is the molecular weight of N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1)?
The molecular weight of N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1) is 261.08 g/mol.
Where can I buy N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1)?
You can request a quote for N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for N,N-Bis(2-chloroethyl)hexan-1-amine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.