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4136-22-5

Basic Information
CAS No.: 4136-22-5
Name: (-)-Dibenzyl D-tartrate
Article Data: 4
Molecular Structure:
Molecular Structure of 4136-22-5 ((-)-Dibenzyl D-tartrate)
Formula: C18H18O6
Molecular Weight: 330.337
Synonyms: Butanedioicacid, 2,3-dihydroxy-, bis(phenylmethyl) ester, (2S,3S)- (9CI);Tartaric acid, dibenzylester, (-)- (8CI);Dibenzyl (S,S)-tartrate;
Density: 1.312 g/cm3
Melting Point: 65-68 °C
Boiling Point: 480.9 °C at 760 mmHg
Flash Point: 171.5 °C
Safety: 22-24/25
PSA: 93.06000
LogP: 1.19500
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Specification

The CAS register number of (-)-Dibenzyl D-tartrate is 4136-22-5. It also can be called as Butanedioic acid,2,3-dihydroxy-, 1,4-bis(phenylmethyl) ester, (2S,3S)- and the systematic name about this chemical is dibenzyl 2,3-dihydroxybutanedioate. The molecular formula about this chemical is C18H18O6 and the molecular weight is 330.33. It belongs to the following product categories, such as Asymmetric Synthesis; Chiral Catalysts, Ligands, and Reagents; EpoxidationChiral Building Blocks; Esters; Organic Building Blocks and so on. When you are using it, please do not breathe dust and avoid contact with skin and eyes.

Physical properties about (-)-Dibenzyl D-tartrate are: (1)ACD/LogP: 2.43; (2)#H bond acceptors: 6; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 11; (5)Polar Surface Area: 71.06Å2; (6)Index of Refraction: 1.593; (7)Molar Refractivity: 85.35 cm3; (8)Molar Volume: 251.7 cm3; (9)Polarizability: 33.83x10-24cm3; (10)Surface Tension: 57.4 dyne/cm; (11)Enthalpy of Vaporization: 78.53 kJ/mol; (12)Boiling Point: 480.9 °C at 760 mmHg; (13)Vapour Pressure: 4.64E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCc1ccccc1)C(O)C(O)C(=O)OCc2ccccc2
(2)InChI: InChI=1/C18H18O6/c19-15(17(21)23-11-13-7-3-1-4-8-13)16(20)18(22)24-12-14-9-5-2-6-10-14/h1-10,15-16,19-20H,11-12H2
(3)InChIKey: LCKIPSGLXMCAOF-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C18H18O6/c19-15(17(21)23-11-13-7-3-1-4-8-13)16(20)18(22)24-12-14-9-5-2-6-10-14/h1-10,15-16,19-20H,11-12H2
(5)Std. InChIKey: LCKIPSGLXMCAOF-UHFFFAOYSA-N