Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate
TL;DR: Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate (CAS 69781-88-0) is a chemical compound with molecular formula C16H22ClNO4S and molecular weight 359.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroethyl-ethyl-methyl-(naphthalen-1-ylmethyl)azanium;hydrogen sulfate
Also Known As: (2-Chloroethyl)ethylmethyl(naphthylmethyl)ammonium methyl sulfate, AMMONIUM, (2-CHLOROETHYL)ETHYLMETHYL(NAPHTHYLMETHYL)-, METHYL SULFATE, 2-Chloroethyl-ethyl-methyl-(naphthalen-1-ylmethyl)azanium; hydrogensulfate, 2-chloroethyl-ethyl-methyl-(naphthalen-1-ylmethyl)azanium; hydrogen sulfate, 2-Chloro-N-ethyl-N-methyl-N-[(naphthalen-1-yl)methyl]ethan-1-aminium hydrogen sulfate
| Molecular Formula | C16H22ClNO4S |
|---|---|
| Molecular Weight | 359.10 g/mol |
| LogP | 3.05 |
| Topological Polar Surface Area | 85.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.0958 |
| Heavy Atoms | 23 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 69781-88-0 |
|---|---|
| SMILES | CC[N+](C)(CCCl)CC1=CC=CC2=CC=CC=C21.OS(=O)(=O)[O-] |
| InChIKey | DODAINIGKXVPDD-UHFFFAOYSA-M |
Product Overview
Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate (CAS 69781-88-0), with molecular formula C16H22ClNO4S and molecular weight 359.10 g/mol. IUPAC: 2-chloroethyl-ethyl-methyl-(naphthalen-1-ylmethyl)azanium;hydrogen sulfate.
Chemical Property Profile of Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate
Property Insights of Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate
The XLogP value of 3.05 indicates that Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate. Following Lipinski's Rule of Five, Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate has 1 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 Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate?
The CAS number of Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate is 69781-88-0.
What is the molecular formula of Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate?
The molecular formula of Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate is C16H22ClNO4S.
What is the molecular weight of Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate?
The molecular weight of Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate is 359.10 g/mol.
Where can I buy Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate?
You can request a quote for Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (2-chloroethyl)ethylmethyl(naphthylmethyl)-, methyl sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.