58-39-9
Product Name:
PERPHENAZINE
Formula:
C21H26ClN3OS
Synonyms:
4-[3-(2-Chloro-10H-phenothiazin-10-yl)propyl]-1-piperazineethanol;Perphenazine
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Solid |
|---|---|
| Color/Form | Crystals |
| Odor | Almost odorless |
| Taste | Bitter taste |
| Boiling Point | 278-281 °C at 1.00E+00 mm Hg |
| Melting Point | 97 °C |
| Solubility | 28.3 mg/L (at 24 °C) |
| LogP | 4.2 |
| LogS | -4.16 |
| Stability/Shelf Life | Sensitive to light |
| Decomposition | When heated to decomposition it emits very toxic fumes of /sulfur and nitrogen oxides/ and /hydrogen chloride/. |
| pH | pH = 4.2 - 5.6 |
| Dissociation Constants | 7.94 |
| Collision Cross Section | 193.2 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)] |
| Kovats Retention Index | 3243 |
| Other Experimental Properties | Osmolality of 5 mg/mL is 263 mOsm/kg |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H317:Sensitisation, Skin |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P302+P352:IF ON SKIN: wash with plenty of soap and water. |
COMPUTED DESCRIPTORS
| Molecular Weight | 404.0 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 403.1485113 g/mol |
| Monoisotopic Mass | 403.1485113 g/mol |
| Topological Polar Surface Area | 55.2 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 463 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Perphenazine is a phenothiazine derivative in which the phenothiazine tricycle carries a chloro substituent at the 2-position and a 3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl group at N-10. It has a role as a phenothiazine antipsychotic drug, a dopaminergic antagonist and an antiemetic. It is a member of phenothiazines, a N-alkylpiperazine, a N-(2-hydroxyethyl)piperazine and an organochlorine compound. It derives from a hydride of a 10H-phenothiazine.