The Phenyl chlorocarbonate, with the CAS registry number 1885-14-9 and EINECS registry number 217-547-8, has the systematic name of phenyl carbonochloridate. And the molecular formula of this chemical is C₁₆H₃₆ClN. It is a kind of clear liquid with a strong odor, and belongs to the following product categories: Miscellaneous; Organics; Chloroformates. In addition, it is sensitive to moisture, and should be stored in the refrigerator. Besides, it is used as reagents for organic synthesis.

The physical properties of Phenyl chlorocarbonate are as following: (1)ACD/LogP: 2.66; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.66; (4)ACD/LogD (pH 7.4): 2.66; (5)ACD/BCF (pH 5.5): 62.02; (6)ACD/BCF (pH 7.4): 62.02; (7)ACD/KOC (pH 5.5): 667.87; (8)ACD/KOC (pH 7.4): 667.87; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.532; (14)Molar Refractivity: 37.81 cm³; (15)Molar Volume: 121.9 cm³; (16)Polarizability: 14.98×10^-24cm³; (17)Surface Tension: 40.4 dyne/cm; (18)Density: 1.283 g/cm³; (19)Flash Point: 79 °C; (20)Enthalpy of Vaporization: 42.28 kJ/mol; (21)Boiling Point: 186.5 °C at 760 mmHg; (22)Vapour Pressure: 0.66 mmHg at 25°C.

Preparation of Phenyl chlorocarbonate: It can be prepared by phenol and phosgene. Dissolve phenol in chloroform, and then pass phosgene. Dilute with water after addition of equimolar N,N-Dimethylaniline. Wash the oil layer with diluted hydrochloric acid and water, and then dry with anhydrous calcium chloride. Heat to get rid of chloroform, and collect the distillate in 74-75°C(1.73kPa) after reduced pressure distillation. The distillate is the product you desired. And the yield is 90%.

Uses of Phenyl chlorocarbonate: It can react with phenylhydrazine to produce 3-phenyl-carbazic acid phenyl ester. This reaction will need solvents diethyl ether and tetrahydrofuran. The reaction time is 0.5 hours with heating, and the yield is about 32%.

You should be cautious while dealing with this chemical. If contact with water, it will liberate toxic gas. It irritates skin, and has risk of serious damage to eyes. It is very toxic by inhalation, and may also cause burns. In addition, it is harmful if swallowed. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice; After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer); In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Cl)Oc1ccccc1
(2)InChI: InChI=1/C7H5ClO2/c8-7(9)10-6-4-2-1-3-5-6/h1-5H
(3)InChIKey: AHWALFGBDFAJAI-UHFFFAOYAM

The toxicity data is as follows: