Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester
TL;DR: Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester (CAS 85437-54-3) is a chemical compound with molecular formula C6H14Cl2NO2P and molecular weight 233.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[dichloromethyl(methoxy)phosphoryl]butan-1-amine
Also Known As: Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester, Methyl N-butyl-P-(dichloromethyl)phosphonamidate, N-(dichloromethyl-methoxy-phosphoryl)butan-1-amine, N-[dichloromethyl(methoxy)phosphoryl]butan-1-amine
| Molecular Formula | C6H14Cl2NO2P |
|---|---|
| Molecular Weight | 233.01 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 233.01392 |
| Heavy Atoms | 12 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 85437-54-3 |
|---|---|
| SMILES | CCCCNP(=O)(C(Cl)Cl)OC |
| InChIKey | JZVQWXVAXDQYBF-UHFFFAOYSA-N |
Product Overview
Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester (CAS 85437-54-3), with molecular formula C6H14Cl2NO2P and molecular weight 233.01 g/mol. IUPAC: N-[dichloromethyl(methoxy)phosphoryl]butan-1-amine.
Chemical Property Profile of Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester
Property Insights of Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester. With a topological polar surface area (TPSA) of 38.3 Ų, Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester has 1 hydrogen bond donor(s) and 3 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 Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester?
The CAS number of Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester is 85437-54-3.
What is the molecular formula of Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester?
The molecular formula of Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester is C6H14Cl2NO2P.
What is the molecular weight of Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester?
The molecular weight of Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester is 233.01 g/mol.
Where can I buy Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester?
You can request a quote for Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonamidic acid, N-butyl-P-(dichloromethyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.