Phosphonic acid,P-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-, diethyl ester supplier

Name
Diethyl [(tetrahydro-2H-pyran-2-yloxy)methyl]phosphonate
EINECS
CAS No. 71885-51-3
Article Data2
CAS DataBase
Density 1.11 g/cm³
Solubility
Melting Point
Formula C₁₀H₂₁O₅P
Boiling Point 338.8 °C at 760 mmHg
Molecular Weight 252.24
Flash Point 172.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Phosphonicacid, [[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-, diethyl ester (9CI);
PSA 63.80000
LogP 2.75320

Phosphonic acid,P-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-, diethyl ester Specification

This chemical is called Phosphonic acid,P-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-, diethyl ester, and its systematic name is diethyl [(tetrahydro-2H-pyran-2-yloxy)methyl]phosphonate. With the molecular formula of C₁₀H₂₁O₅P, its molecular weight is 252.24. The CAS registry number of this chemical is 71885-51-3.

Other characteristics of the Phosphonic acid,P-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-, diethyl ester can be summarised as followings: (1)ACD/LogP: 0.67; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.67; (4)ACD/LogD (pH 7.4): 0.67; (5)ACD/BCF (pH 5.5): 1.9; (6)ACD/BCF (pH 7.4): 1.9; (7)ACD/KOC (pH 5.5): 55.02; (8)ACD/KOC (pH 7.4): 55.02; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 63.8 Å²; (13)Index of Refraction: 1.441; (14)Molar Refractivity: 59.98 cm³; (15)Molar Volume: 226.8 cm³; (16)Polarizability: 23.78×10^-24cm³; (17)Surface Tension: 34.9 dyne/cm; (18)Density: 1.11 g/cm³; (19)Flash Point: 172.4 °C; (20)Enthalpy of Vaporization: 55.91 kJ/mol; (21)Boiling Point: 338.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000189 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=P(OCC)(OCC)COC1OCCCC1
2.InChI: InChI=1/C10H21O5P/c1-3-14-16(11,15-4-2)9-13-10-7-5-6-8-12-10/h10H,3-9H2,1-2H3
3.InChIKey: RUPVGTAIRUGQIQ-UHFFFAOYAW

Product Name

Diethyl [(tetrahydro-2H-pyran-2-yloxy)methyl]phosphonate

Phosphonic acid,P-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-, diethyl ester Specification

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