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Name |
Phosphoramidic acid,diethyl ester |
EINECS | N/A |
CAS No. | 1068-21-9 | Density | 1.133 g/cm3 |
PSA | 71.36000 | LogP | 1.82650 |
Solubility | N/A | Melting Point |
51-53 °C(lit.) |
Formula | C4H12NO3P | Boiling Point | 309.1 °C at 760 mmHg |
Molecular Weight | 153.118 | Flash Point | 140.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Diethyl Phosphoramidate;Amidophosphoric acid diethyl ester; |
Article Data | 38 |
The Phosphoramidic acid,diethyl ester, with the CAS registry number 1068-21-9, is also known as Diethyl Phosphoramidate. It belongs to the product categories of Amination; Synthetic Organic Chemistry; Organic Building Blocks; Phosphoramidites; Phosphorus Compounds. This chemical's molecular formula is C4H12NO3P and molecular weight is 153.12. What's more, its IUPAC name is [amino(ethoxy)phosphoryl]oxyethane.
Physical properties of Phosphoramidic acid,diethyl ester are: (1)ACD/LogP: -0.31; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.31; (4)ACD/LogD (pH 7.4): -0.31; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 16.19; (8)ACD/KOC (pH 7.4): 16.19; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 48.58 Å2; (13)Index of Refraction: 1.424; (14)Molar Refractivity: 34.47 cm3; (15)Molar Volume: 135.1 cm3; (16)Polarizability: 13.66×10-24cm3; (17)Surface Tension: 36.3 dyne/cm; (18)Density: 1.133 g/cm3; (19)Flash Point: 140.7 °C; (20)Enthalpy of Vaporization: 54.98 kJ/mol; (21)Boiling Point: 309.1 °C at 760 mmHg; (22)Vapour Pressure: 0.000652 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: O=P(OCC)(OCC)N
(2)Std. InChI: InChI=1S/C4H12NO3P/c1-3-7-9(5,6)8-4-2/h3-4H2,1-2H3,(H2,5,6)
(3)Std. InChIKey: MCQILDHFZKTBOD-UHFFFAOYSA-N