76203-93-5

Basic information

• Product Name: Carbamic acid, [(hydroxymethoxyphosphinyl)methyl]-, phenylmethyl ester
• CAS NO: 76203-93-5
• Molecular Formula: C10H14NO5P
• Molecular Weight: 259.199
• Mol File: 76203-93-5.mol
• Article Data: 7

Chemical Properties

• CAS DataBase Reference: Carbamic acid, [(hydroxymethoxyphosphinyl)methyl]-, phenylmethyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: Carbamic acid, [(hydroxymethoxyphosphinyl)methyl]-, phenylmethyl ester(76203-93-5)
• EPA Substance Registry System: Carbamic acid, [(hydroxymethoxyphosphinyl)methyl]-, phenylmethyl ester(76203-93-5)

Safety Data

• Hazardous Substances Data: 76203-93-5(Hazardous Substances Data)

Upstream product

• 67799-92-2 benzyloxycarbonylaminomethyl acetate 
• 621-84-1 O-benzyl carbamate 
• 90210-45-0 N-benzyloxycarbonylaminomethanephosphonic acid 2-cyanoethyl monoester 
• 55601-40-6 N-(benzyloxycarbonyl)aminomethylphosphonic acid 
• 77393-49-8 diphenyl [(([(phenylmethyl)oxy]carbonyl)amino)methyl]phosphonate 
• 90210-40-5 (Benzyloxycarbonylamino-methyl)-phosphonic acid 2-cyano-ethyl ester methyl ester 
• 59191-35-4 dimethyl N-(benzyloxycarbonyl)aminomethylphosphonate 

Downstream Products

• 1400929-62-5 (S)-2-((N-(benzyloxycarbonyl)aminomethylphosphonyl)amino)-N,4-dimethylpentanamide lithium 
• 1400929-63-6 (S)-2-((N-(benzyloxycarbonyl)aminomethylphosphonyl)amino)-N-ethyl-4-methylpentanamide lithium 
• 1252575-05-5 C₂₃H₃₈N₃O₇P 

Relevant articles and documents

Additivity or cooperativity: Which model can predict the influence of simultaneous incorporation of two or more functionalities in a ligand molecule?

Predicting how binding affinity responds to ligand structural modifications in structure-activity relationship studies (SAR) is a major challenge in medicinal chemistry. This is particularly true when two or more of these modifications are carried out simultaneously. In this study, we present binding affinity data from several series of thermolysin inhibitors in which simultaneous structural modifications were investigated to determine whether they are cooperative or additive. Data revealed that, while additivity is at work in some cases, cooperativity is more commonly demonstrated. Cooperativity and additivity were then correlated with ligand descriptors, such as the spacing and the topological features of the modified groups, in a manner that may provide guidance as to when each model should be utilized. Cooperativity was particularly associated with contiguous groups and small unbranched hydrophobic side chain. Additivity, on the other hand, was associated with moderately distant hydrophobic group combinations and side chain branching. Such correlations can improve the predictability of SAR studies and can provide a starting point for additional investigations that may lead to further significant enhancements in the current scoring functions.

Water mediated ligand functional group cooperativity: The contribution of a methyl group to binding affinity is enhanced by a COO- group through changes in the structure and thermodynamics of the hydration waters of ligand-thermolysin complexes

Ligand functional groups can modulate the contributions of one another to the ligand-protein binding thermodynamics, producing either positive or negative cooperativity. Data presented for four thermolysin phosphonamidate inhibitors demonstrate that the d

Reactive species formed from N-benzyloxycarbonyl α-aminophosphonochloridates and triethylamine: Probable identity and implications for synthesis

The sterically congested phosphonochloridate BnOCONHCMe2P(O)(OMe)Cl reacts rapidly with Et3N to give what is thought to be an oxazaphospholine oxide 7 (and Et3NHCl); unhindered BnOCONHCH2P(O)(OMe)Cl seems to rea