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| CAS No.: | 2356-16-3 |
|---|---|
| Name: | Triethyl 2-fluoro-2-phosphonoacetate |
| Article Data: | 37 |
| Molecular Structure: | |
|
|
|
| Formula: | C8H16FO5P |
| Molecular Weight: | 242.184 |
| Synonyms: | Aceticacid, (diethoxyphosphinyl)fluoro-, ethyl ester (9CI);Acetic acid,fluorophosphono-, triethyl ester (7CI,8CI);(diethoxyphosphinyl)fluoroaceticacid ethyl ester;2-(Diethoxyphosphoryl)-2-fluoroacetic acid ethyl ester;2-Fluoro-2-phosphonoacetic acid triethyl ester;Diethyl(1-fluoro-1-carbethoxymethyl)phosphonate;Diethyl [(ethoxycarbonyl)fluoromethyl]phosphonate;Ethyl (diethoxyphosphoryl)fluoroacetate;Ethyl2-(diethoxyphosphinyl)-2-fluoroacetate;Ethyl diethylphosphonofluoroacetate;Triethyl 2-fluoro-2-phosphonoacetate;Triethyl fluorophosphonoacetate;Triethylphosphonofluoroacetate;Triethyl a-fluoro(phosphono)acetate; |
| EINECS: | -0 |
| Density: | 1.171 g/cm3 |
| Boiling Point: | 339.5 °C at 760 mmHg |
| Flash Point: | 73.9 °C |
| Appearance: | clear colorless liquid |
| Hazard Symbols: |
 Xi;  F
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36-37/39 |
| PSA: | 71.64000 |
| LogP: | 2.11120 |
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Chemistry
Product Name: Triethyl fluorophosphonoacetate (CAS NO.2356-16-3)
Molecular Formula: C8H16FO5P
Molecular Weight: 242.18g/mol
Mol File: 2356-16-3.mol
Boiling point: 339.5 °C at 760 mmHg
Flash Point: 73.9 °C
Density: 1.171 g/cm3
Refractive index: n20/D 1.425(lit.)
Surface Tension: 32.4 dyne/cm
Enthalpy of Vaporization: 58.3 kJ/mol
Vapour Pressure: 9.13E-05 mmHg at 25°C
XLogP3-AA: 1
H-Bond Donor: 0
H-Bond Acceptor: 6
Structure Descriptors of Triethyl fluorophosphonoacetate (CAS NO.2356-16-3):
IUPAC Name: ethyl (2R)-2-diethoxyphosphoryl-2-fluoroacetate
Canonical SMILES: CCOC(=O)C(F)P(=O)(OCC)OCC
Isomeric SMILES: CCOC(=O)[C@H](F)P(=O)(OCC)OCC
InChI: InChI=1S/C8H16FO5P/c1-4-12-8(10)7(9)15(11,13-5-2)14-6-3/h7H,4-6H2,1-3H3/t7-/m1/s1
InChIKey: FVPISMANESAJQZ-SSDOTTSWSA-N
Product Categories: Phosphorus compounds; Fluorinated Building Blocks; Fluorinating Reagents & Building Blocks for Fluorinated Biochemical Compounds; Horner-Emmons Reaction; Synthetic Organic Chemistry; Wittig & Horner-Emmons Reaction; C-C Bond Formation; Horner-Wadsworth-Emmons Reagents; Olefination
Safety Profile
Safety Information of Triethyl fluorophosphonoacetate (CAS NO.2356-16-3):
Hazard Codes: Xi
,F
Risk Statements: 36/37/38
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
Safety Statements: 26-36-37/39
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
37: Wear suitable gloves
39: Wear eye/face protection
WGK Germany: 3
F: 10-21
Hazard Note: Irritant
HazardClass: IRRITANT, FLAMMABLE
Specification
Triethyl fluorophosphonoacetate , its CAS NO. is 2356-16-3, the synonyms are Triethyl phosphonofluoroacetate ; Acetic acid, (diethoxyphosphinyl)fluoro-, ethyl ester .