95-88-5
4-Chlororesorcinol
CAS: 95-88-5
Molecular Formula: C6H5ClO2
95-88-5 - Names and Identifiers
| Name | 4-Chlororesorcinol |
| Synonyms | C.I. 76510 4-chlororesorcin 4-Chlororesorcinol 4-Chloro Resorcinol Monochlororesorcinol 4- chlorineResorcinol 4-chloro-3-benzenediol 3-Benzenediol,4-chloro-1 Phloroglucinol Impurity 21 1,3-Benzenediol, 4-chloro- 2,4-dihydroxychlorobenzene 1-Chloro-2,4-dihydroxybenzene |
| CAS | 95-88-5 |
| EINECS | 202-462-0 |
| InChI | InChI=1/C6H5ClO2/c7-5-2-1-4(8)3-6(5)9/h1-3,8-9H |
95-88-5 - Physico-chemical Properties
| Molecular Formula | C6H5ClO2 |
| Molar Mass | 144.56 |
| Density | 1.2558 (rough estimate) |
| Melting Point | 106-108 °C (lit.) |
| Boling Point | 147 °C/18 mmHg (lit.) |
| Flash Point | 146-148°C/18mm |
| Water Solubility | soluble |
| Solubility | Soluble in water, alcohol, ether, benzene and carbon disulfide. |
| Vapor Presure | 0.16Pa at 25℃ |
| Appearance | Colorless crystal |
| Color | Beige |
| BRN | 2042864 |
| pKa | 8.28±0.10(Predicted) |
| PH | 3.8 (10g/l, H2O, 30℃) |
| Storage Condition | Keep in dark place,Inert atmosphere,Room temperature |
| Stability | Stable. Incompatible with acid chlorides, acid anhydrides, oxidizing agents. |
| Sensitive | Air sensitive, light sensitive |
| Refractive Index | 1.4620 (estimate) |
| MDL | MFCD00002273 |
| Physical and Chemical Properties | Colorless crystals. Melting point 89 ℃(106.5-107.5 ℃), boiling point 259 ℃,147 ℃(2.4kPa). Soluble in water, alcohol, ether, benzene and carbon disulfide. Can sublimate. It reacts with ferric chloride to produce blue-purple. |
| Use | Mainly used in organic synthesis |
95-88-5 - Risk and Safety
| Hazard Symbols | Xn - Harmful |
| Risk Codes | R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. R36/37/38 - Irritating to eyes, respiratory system and skin. R22 - Harmful if swallowed |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36 - Wear suitable protective clothing. S22 - Do not breathe dust. |
| WGK Germany | 3 |
| RTECS | VH0450000 |
| TSCA | Yes |
| HS Code | 29081000 |
95-88-5 - Reference Information
| LogP | 0.895 at 25℃ |
| NIST chemical information | information provided by: webbook.nist.gov (external link) |
| EPA chemical substance information | information provided by: ofmpeb.epa.gov (external link) |
| purpose | used in organic synthesis, preparation of various Ether derivatives; Used for printing drawings; Analysis reagent. mainly used in organic synthesis |
| production method | is obtained from the reaction of resorcinol with dichlorothioyl. Resorcinol and diethyl ether were mixed, heated to reflux with stirring, and dichlorosulfuryl was slowly added dropwise. Then warm to 60 degrees Celsius for 1H. The ether was recovered and then subjected to atmospheric distillation, and the distillate was further distilled under reduced pressure to collect a fraction of 131 ° C. (0.8-0.93kPa) or 160-164 ° C. (4.0kPa) to obtain a finished product. |
Last Update：2024-04-09 21:04:16
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