Ethyl diethoxyphosphinylformate - CAS 1474-78-8
Catalog: |
BB043128 |
Product Name: |
Ethyl diethoxyphosphinylformate |
CAS: |
1474-78-8 |
Synonyms: |
Diethyl (Ethoxycarbonyl)phosphonate; Foscarnet Related Compound D; Phosphonoformic Acid Triethyl Ester; Diethoxyphosphinecarboxylic Acid Ethyl Ester Oxide; Diethyl Carbethoxyphosphonate; Ethyl Diethylphosphonoformate; NSC 108684; Triethyl Carboxyphosphonate; Triethyl Phosphonoformate; USP Foscarnet Related Compound D |
IUPAC Name: | ethyl diethoxyphosphorylformate |
Description: | Ethyl diethoxyphosphinylformate is an impurity in the synthesis of Foscarnet, which is a DNA polymerase inhibitor with activity against several viruses. |
Molecular Weight: | 210.17 |
Molecular Formula: | C7H15O5P |
Canonical SMILES: | CCOC(=O)P(=O)(OCC)OCC |
InChI: | InChI=1S/C7H15O5P/c1-4-10-7(8)13(9,11-5-2)12-6-3/h4-6H2,1-3H3 |
InChI Key: | NOJFJZZMRDSOLM-UHFFFAOYSA-N |
Boiling Point: | 135°C at 12 mmHg |
Purity: | ≥95% |
Density: | 1.11 g/mL at 25°C |
Solubility: | Soluble in Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Clear Colorless Liquid |
Storage: | Store at 2-8°C |
GHS Hazard Statement: | H315 (33.33%): Causes skin irritation [Warning Skin corrosion/irritation]; H317 (66.67%): May cause an allergic skin reaction [Warning Sensitization, Skin]; H319 (33.33%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P261, P264, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P332+P317, P333+P313, P337+P317, P362+P364, and P501 |
Signal Word: | Warning |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.06571057 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.06571057 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 61.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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