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59564-78-2

Basic Information
CAS No.: 59564-78-2
Name: 1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid
Molecular Structure:
Molecular Structure of 59564-78-2 (1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid)
Formula: C19H18N2O5
Molecular Weight: 354.36
Synonyms: 1,3-Dibenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid;
EINECS: 261-806-8
Density: 1.426 g/cm3
Melting Point: 170-174 °C(lit.)
Boiling Point: 654.2 °C at 760 mmHg
Flash Point: 349.5 °C
Solubility:
Appearance: white crystal powder
Hazard Symbols:
Risk Codes:
Safety:
Transport Information:
PSA: 98.15000
LogP: 1.90660
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  • 1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid

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  • 1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid

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    59564-78-2

    1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid

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    high quality Storage:Sealed, dry, microtherm , avoid light and smell. Package:According to the demand of customer Application:Organic synthesis Transportation:by air or by sea

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  • 1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid

  • Casno:

    59564-78-2

    1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid

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Specification

The 1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid, with the CAS registry number 59564-78-2, is also known as 1,3-Dibenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid. It belongs to the product categories of Organic Acids; Heterocyclic Compounds; (intermediate of d-biotin); Building Blocks; Heterocyclic Building Blocks; Imidazolines/Imidazolidines. Its EINECS registry number is 261-806-8. This chemical's molecular formula is C11H8O4 and molecular weight is 354.36. Its IUPAC name is called 1,3-bis(furan-2-yl)propane-1,3-dione. The product should be sealed and stored in cool and dry place. It can be used as intermediates of Biotin.

Physical properties of 1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid: (1)ACD/LogP: 3.49; (2)ACD/LogD (pH 5.5): 1.23; (3)ACD/LogD (pH 7.4): -1.21; (4)ACD/BCF (pH 5.5): 1.45; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 10.37; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 7; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 6; (11)Index of Refraction: 1.659; (12)Molar Refractivity: 91.64 cm3; (13)Molar Volume: 248.4 cm3; (14)Surface Tension: 73.1 dyne/cm; (15)Density: 1.426 g/cm3; (16)Flash Point: 349.5 °C; (17)Enthalpy of Vaporization: 101.26 kJ/mol; (18)Boiling Point: 654.2 °C at 760 mmHg; (19)Vapour Pressure: 5.22E-18 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=COC(=C1)C(=O)CC(=O)C2=CC=CO2
(2)InChI: InChI=1S/C11H8O4/c12-8(10-3-1-5-14-10)7-9(13)11-4-2-6-15-11/h1-6H,7H2
(3)InChIKey: KCLJMJPZQAPYOG-UHFFFAOYSA-N