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Cyanophosphonic acid ethyl dimethylamide

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Identification
Molecular formula
C5H11NO2P
CAS number
2439-06-5
IUPAC name
[dimethylamino(ethoxy)phosphoryl]formonitrile
State
State

At room temperature, the compound is typically in a liquid state. It should be handled with care due to its potential reactivity and chemical properties.

Melting point (Celsius)
-40.00
Melting point (Kelvin)
233.15
Boiling point (Celsius)
205.00
Boiling point (Kelvin)
478.15
General information
Molecular weight
148.14g/mol
Molar mass
148.1420g/mol
Density
1.0800g/cm3
Appearence

The compound usually appears as a colorless to light yellow liquid, depending on its purity.

Comment on solubility

Solubility of [dimethylamino(ethoxy)phosphoryl]formonitrile

Solubility plays a crucial role in understanding the behavior and application of [dimethylamino(ethoxy)phosphoryl]formonitrile. Its solubility characteristics can be influenced by several factors, which are important to consider:

  • Polarity: The presence of polar groups in the molecule, such as the dimethylamino and ethoxy functionalities, can enhance solubility in polar solvents like water.
  • Hydrogen Bonding: The ability of the compound to form hydrogen bonds will significantly affect its solubility. Strong hydrogen bonding can increase solubility in polar solvents.
  • Solvent Interactions: Understanding the interactions between [dimethylamino(ethoxy)phosphoryl]formonitrile and potential solvents is crucial. It may be soluble in organic solvents like ethanol or acetone if the polar character is balanced.

In conclusion, while specific solubility data may be limited, the compound’s structure suggests it could be soluble in certain polar solvents and potentially exhibit varied solubility in organic solvents based on their characteristics. To confirm practical applications, experimental solubility tests in various solvents are recommended.

Interesting facts

Interesting Facts about [Dimethylamino(ethoxy)phosphoryl]formonitrile

[Dimethylamino(ethoxy)phosphoryl]formonitrile is a fascinating compound that showcases a range of intriguing characteristics and applications. As a phosphorus-containing organic molecule, it plays a significant role in various fields, particularly in medicinal chemistry and agrochemicals.

1. Versatility in Chemical Synthesis

This compound serves as a versatile intermediate in the synthesis of other important chemical entities. Its unique structure allows it to participate in a variety of reactions, making it a valuable building block in the development of pharmaceuticals and agrochemicals. Researchers often utilize it for:

  • Synthesis of new drug candidates
  • Development of innovative pesticides
  • Creation of novel ligands in coordination chemistry

2. Role in Medicinal Chemistry

In the realm of medicinal chemistry, [Dimethylamino(ethoxy)phosphoryl]formonitrile is noteworthy for its potential biological activities. The presence of the dimethylamino group is known to enhance the molecule's interaction with biological targets, which can lead to:

  • Enhanced efficacy against specific diseases
  • Increased selectivity towards certain biomolecules
  • Potential for reduced side effects

3. Environmental Considerations

As a compound that can find use in the agricultural sector, its environmental impact is an essential factor to consider. Studies on phosphorus-containing compounds often highlight their role in nutrient cycling and the potential for reducing chemical fertilizers’ usage – promoting sustainable practices in agriculture.

4. Structure-Activity Relationship (SAR)

The structure-activity relationship is a critical concept for chemists investigating this compound. A detailed understanding of how variations in its chemical structure affect biological activity can lead to:

  • Development of more potent and selective agents
  • Insights into mechanisms of action at the molecular level
  • Guidance for further synthetic modifications

In conclusion, [Dimethylamino(ethoxy)phosphoryl]formonitrile is not just a mere chemical compound; it is a key player in the synthesis of important pharmaceutical and agricultural products that impact our daily lives. As research continues, its significance in various scientific fields will surely expand.

Synonyms
TABUN
77-81-6
Taboon A
Gelan I
Trilon 83
Ethyl dimethylphosphoramidocyanidate
Dimethylamidoethoxyphosphoryl cyanide
Ethyl dimethylamidocyanophosphate
Ethyl N,N-dimethylphosphoramidocyanidate
GA (chemical warfare agent)
Le-100
Ethyl phosphorodimethylamidocyanidate
Ethyl N-dimethylphosphoramidocyanidate
[dimethylamino(ethoxy)phosphoryl]formonitrile
CCRIS 3421
Dimethylphosphoramidocyanidic acid, ethyl ester
EA 1205
TL 1578
HSDB 6378
Ethyl dimethylphosphoramido cyanidate
UNII-S45M750QSH
GA [Chemical Warfare Agent]
T-2104
BRN 1769395
Dimethylaminocyanphosphorsaeureaethylester
S45M750QSH
N,N-dimethylamido-O-ethyl cyanophosphate
Phosphoramidocyanidic acid, dimethyl-, ethyl ester
O-Ethyl N,N-dimethylphosphoramidocyanidate
Ethylester-dimethylamid kyseliny kyanfosfonove
TABUN [MI]
Dimethylaminocyanphosphorsaeureaethylester [German]
Ethylester-dimethylamid kyseliny kyanfosfonove [Czech]
O-Ethyl N,N-dimethyl phosphoramidocyanidate
CHEMBL446997
(+/-)-TABUN
DTXSID80861631
4-04-00-00275 (Beilstein Handbook Reference)
Phosphoramidocyanidic acid, N,N-dimethyl-, ethyl ester
Ethyl N,N-dimethylamino cyanophosphate
N,N-DIMETHYLPHOSPHORAMIDOCYANIDIC ACID ETHYL ESTER
Dimethylaminocyanphosphorsaeureaethylester (German)
Ethylester-dimethylamid kyseliny kyanfosfonove (Czech)
Nerve Agent GA
Agent GA
SCHEMBL60863
Le100
G-SERIES NERVE AGENT GA
DTXCID80810528
Ethyl Ndimethylphosphoramidocyanidate
Ethyl dimethylamidocyanidophosphate #
BDBM50241987
AKOS006277925
Ethyl N,Ndimethylphosphoramidocyanidate
OEthyl N,Ndimethylphosphoramidocyanidate
ETHYL DIMETHYLAMIDOCYANO-PHOSPHATE
PD193237
Ethylesterdimethylamid kyseliny kyanfosfonove
NS00076441
T2104
Phosphoramidocyanidic acid, dimethyl, ethyl ester
Q143289
Phosphoramidocyanidic acid, N,Ndimethyl, ethyl ester
PHOSPHORAMIDO-CYANIDIC ACID, DIMETHYL-, ETHYL ESTER