1-(Dimethylamino)-1-chloroethane-1-phosphonic acid
TL;DR: 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid (CAS 71550-35-1) is a chemical compound with molecular formula C4H11ClNO3P and molecular weight 187.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R)-1-chloro-1-(dimethylamino)ethyl]phosphonic acid
Also Known As: 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid, Phosphonic acid, (1-chloro-1-(dimethylamino)ethyl)-, [(1R)-1-chloro-1-(dimethylamino)ethyl]phosphonic acid, Phosphonic acid, P-(1-chloro-1-(dimethylamino)ethyl)-, Phosphonic acid,(1-chloro-1-(dimethylamino)ethyl)
| Molecular Formula | C4H11ClNO3P |
|---|---|
| Molecular Weight | 187.02 g/mol |
| LogP | 0.6382 |
| Topological Polar Surface Area | 60.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.01651 |
| Heavy Atoms | 10 |
| Complexity | 163.88564 |
Chemical Identifiers
| CAS Number | 71550-35-1 |
|---|---|
| SMILES | C[C@@](N(C)C)(P(=O)(O)O)Cl |
Product Overview
1-(Dimethylamino)-1-chloroethane-1-phosphonic acid (CAS 71550-35-1), with molecular formula C4H11ClNO3P and molecular weight 187.02 g/mol. IUPAC: [(1R)-1-chloro-1-(dimethylamino)ethyl]phosphonic acid.
Chemical Property Profile of 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid
Property Insights of 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid
The XLogP value of 0.6382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid. The TPSA of 60.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid. Following Lipinski's Rule of Five, 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid has 2 hydrogen bond donor(s) and 2 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-(Dimethylamino)-1-chloroethane-1-phosphonic acid?
The CAS number of 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid is 71550-35-1.
What is the molecular formula of 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid?
The molecular formula of 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid is C4H11ClNO3P.
What is the molecular weight of 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid?
The molecular weight of 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid is 187.02 g/mol.
Where can I buy 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid?
You can request a quote for 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(Dimethylamino)-1-chloroethane-1-phosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.