| Name | Diphenylcarbamide |
| Synonyms | acardite carbanilide diphenylurea 3-diphenylurea 1,1-diphenylurea 1,3-Diphenylurea sym-Diphenylurea Diphenylcarbamide N,N'-diphenylurea |
| CAS | 102-07-8 |
| EINECS | 203-003-7 |
| InChI | InChI=1/C13H12N2O/c14-13(16)15(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,14,16) |
| InChIKey | GWEHVDNNLFDJLR-UHFFFAOYSA-N |
| Molecular Formula | (C6H5NH)2CO |
| Molar Mass | 212.25 |
| Density | 1.214g/cm3 |
| Melting Point | 239-241℃ |
| Boling Point | 358.7°C at 760 mmHg |
| Flash Point | 170.7°C |
| Water Solubility | 150.3mg/L(temperature not stated) |
| Vapor Presure | 2.5E-05mmHg at 25°C |
| Appearance | Shape Crystalline Powder, color White |
| pKa | 14.15±0.70(Predicted) |
| Storage Condition | Sealed in dry,Room Temperature |
| Stability | Stable. Incompatible with strong oxidizing agents. |
| Refractive Index | 1.651 |
| MDL | MFCD00003017 |
| Physical and Chemical Properties | colorless prisms crystals. The melting point of 239-240 deg C, boiling point of 260 deg C, the relative density of 1.239. Soluble in acetic acid, ether, pyridine-soluble, very slightly soluble in water, alcohol, acetone and chloroform. |
| Use | It is mainly used as an intermediate of sulfanilamide, and its chlorosulfonated product can be used as the main raw material of sulfamethoxazole |
| Risk Codes | R22 - Harmful if swallowed |
| Safety Description | S22 - Do not breathe dust. S24/25 - Avoid contact with skin and eyes. |
| UN IDs | 2811 |
| WGK Germany | 3 |
| RTECS | FD9800000 |
| TSCA | Yes |
| HS Code | 29242100 |
| Hazard Class | 6.1(b) |
| Packing Group | III |
| Raw Materials | Dichloromethane Aniline Phenyl isocyanate |
| Downstream Products | Nicarbazin N-BOC ANILINE 1,2,3-TRIPHENYLGUANIDINE Quinazoline |
| Solubility | pyridine: soluble50mg/mL, clear to very slightly hazy, colorless to faintly yellow |
| Merck | 14,1785 |
| BRN | 782650 |
| NIST chemical information | Urea, N,N'-diphenyl-(102-07-8) |
| EPA chemical information | Carbanilide (102-07-8) |
Introduction
1, 3-diphenylurea is a urea compound. Urea refers to a compound containing R1R2N-CO-NR1R2 functional groups, which is the first type of organic compound synthesized artificially.
method of synthesis
1, 3-diphenylurea was synthesized from N-cyclohexanoyloxybenzamide: [RuCl2(p-cymene)]2(0.005),N-cyclohexanoyloxybenzamide (0.2mol), silver acetate (AgOAc)(0.4mol) and dioxane solvent (dioxane)(1mL) were sequentially added to a dry reaction tube at room temperature and under empty atmosphere, then the temperature was raised to 80 ℃ for 12 hours, and the product was separated by column chromatography after the reaction, with a yield of 94%.
Production method
It is obtained by condensation of aniline and urea.
category
Toxic substances
Toxicity classification
Poisoning
Acute toxicity
oral administration-rat LDL0: 500 mg/kg; Abdominal cavity-mouse LD50: 200 mg/kg
flammability hazard characteristics
Thermal decomposition discharges toxic nitrogen oxide smoke
storage and transportation features
Warehouse low temperature ventilation and drying
Fire extinguishing agent
Water, carbon dioxide, foam, dry powder
| toxic substance data | 102-07-8(Hazardous Substances Data) |