1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride
TL;DR: 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride (CAS 98428-12-7) is a chemical compound with molecular formula C7H15Cl4NO and molecular weight 268.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N,N-bis(2-chloroethyl)propan-1-amine oxide;hydrochloride
Also Known As: N,N-Bis(2-chloroethyl)-2-chloropropylamine N-oxide hydrochloride, 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride, 2-Chloro-N,N-bis(2-chloroethyl)-1-propylamine N-oxide hydrochloride, 2-chloro-N,N-bis(2-chloroethyl)propan-1-amine oxide hydrochloride, 2-Chloro-N,N-bis(2-chloroethyl)propan-1-amine N-oxide--hydrogen chloride (1/1)
| Molecular Formula | C7H15Cl4NO |
|---|---|
| Molecular Weight | 268.99 g/mol |
| LogP | 2.8277 |
| Topological Polar Surface Area | 23.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 268.99078 |
| Heavy Atoms | 13 |
| Complexity | 117.06017 |
Chemical Identifiers
| CAS Number | 98428-12-7 |
|---|---|
| SMILES | CC(C[N+](CCCl)(CCCl)[O-])Cl.Cl |
Product Overview
1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride (CAS 98428-12-7), with molecular formula C7H15Cl4NO and molecular weight 268.99 g/mol. IUPAC: 2-chloro-N,N-bis(2-chloroethyl)propan-1-amine oxide;hydrochloride.
Chemical Property Profile of 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride
Property Insights of 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride
The XLogP value of 2.8277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride. With a topological polar surface area (TPSA) of 23.06 Ų, 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride has 0 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 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride?
The CAS number of 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride is 98428-12-7.
What is the molecular formula of 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride?
The molecular formula of 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride is C7H15Cl4NO.
What is the molecular weight of 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride?
The molecular weight of 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride is 268.99 g/mol.
Where can I buy 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride?
You can request a quote for 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Propylamine, 2-chloro-N,N-bis(2-chloroethyl)-, N-oxide, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.