2,2-Dihydroxypropanedioic acid 1,3-diethyl ester supplier

Name
Diethyl bis(hydroxymetyl)malonate
EINECS
CAS No. 631-23-2
Article Data5
CAS DataBase
Density 1.229 g/cm³
Solubility
Melting Point
Formula C₇H₁₂O₆
Boiling Point 351.3 °C at 760 mmHg
Molecular Weight 192.169
Flash Point 134.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Propanedioicacid, dihydroxy-, diethyl ester (9CI);
PSA 93.06000
LogP -0.91640

2,2-Dihydroxypropanedioic acid 1,3-diethyl ester Specification

The 2,2-Dihydroxypropanedioic acid 1,3-diethyl ester with its cas register number is 631-23-2. It also can be called as Propanedioic acid,2,2-dihydroxy-, 1,3-diethyl ester and the Systematic name about this chemical is diethyl bis(hydroxymethyl)propanedioate.

Physical properties about 2,2-Dihydroxypropanedioic acid 1,3-diethyl ester are: (1)ACD/LogP: -0.39; (2)#H bond acceptors: 6; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 10; (5)Polar Surface Area: 71.06Å²; (6)Index of Refraction: 1.473; (7)Molar Refractivity: 50.32 cm³; (8)Molar Volume: 179.1 cm³; (9)Polarizability: 19.95x10^-24cm³; (10)Surface Tension: 46.6 dyne/cm; (11)Enthalpy of Vaporization: 69.01 kJ/mol; (12)Vapour Pressure: 2.45E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)C(C(=O)OCC)(CO)CO
(2)InChI: InChI=1/C9H16O6/c1-3-14-7(12)9(5-10,6-11)8(13)15-4-2/h10-11H,3-6H2,1-2H3
(3)InChIKey: WIOHBOKEUIHYIC-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C9H16O6/c1-3-14-7(12)9(5-10,6-11)8(13)15-4-2/h10-11H,3-6H2,1-2H3
(5)Std. InChIKey: WIOHBOKEUIHYIC-UHFFFAOYSA-N

Product Name

Diethyl bis(hydroxymetyl)malonate

2,2-Dihydroxypropanedioic acid 1,3-diethyl ester Specification

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