CAS No.538-37-4,Dibenzylphosphoryl chloride Suppliers

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Basic Information

Molecular Structure:
CAS No.:	538-37-4
Name:	Dibenzylphosphoryl chloride
Article Data:	71
Cas Database

Formula:	C₁₄H₁₄ClO₃P
Molecular Weight:	296.69
Synonyms:	Benzylchlorophosphate, OP(OCH2Ph)2Cl (4CI);Benzyl phosphorochloridate (6CI,7CI);Phosphorochloridic acid, dibenzyl ester (8CI);Bis(phenylmethyl)phosphorochloridate;DBPCl;Dibenzyl chlorophosphate;Dibenzylphosphorochloridate;Dibenzylphosphoryl chloride;
Density:	1.283 g/cm³
Boiling Point:	428.2 °C at 760 mmHg
Flash Point:	339.9 °C
PSA:	45.34000
LogP:	4.76690

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Specification

The Phosphorochloridicacid, bis(phenylmethyl) ester, with the CAS registry number 538-37-4, is also known as Dibenzylphosphorylchloride. It belongs to the product categories of Phospholipids - 13C & 2H; Phosphorylating and Phosphitylating Agents. This chemical's molecular formula is C₁₄H₁₄ClO₃P and molecular weight is 264.687121. Its IUPAC name is called [benzyl(chloro)phosphoryl]methylbenzene.

Physical properties of Phosphorochloridicacid, bis(phenylmethyl) ester: (1)ACD/LogP: 3.70 ; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 6; (4)Index of Refraction: 1.566; (5)Molar Refractivity: 75.5 cm³; (6)Molar Volume: 231.2 cm³; (7)Surface Tension: 47.1 dyne/cm; (8)Density: 1.283 g/cm³; (9)Flash Point: 339.9 °C; (10)Enthalpy of Vaporization: 65.69 kJ/mol; (11)Boiling Point: 428.2 °C at 760 mmHg; (12)Vapour Pressure: 3.85E-07 mmHg at 25°C.

Preparation: this chemical can be prepared by phosphonic acid dibenzyl ester. This reaction will need reagent SO₂Cl₂ and solvent CCl₄. The reaction time is 1 hour with reaction temperature of 20 °C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)CP(=O)(CC2=CC=CC=C2)Cl
(2)InChI: InChI=1S/C14H14ClOP/c15-17(16,11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14/h1-10H,11-12H2
(3)InChIKey: SMVXYBYTGKEHCS-UHFFFAOYSA-N