579-56-6
Product Name:
ISOXSUPRINE HYDROCHLORIDE
Formula:
C18H24ClNO3
Synonyms:
(1RS,2SR)-1-(4-Hydroxyphenyl)-2-[(1SR)1-methyl-2-phenoxyethylamino]propan-1-ol hydrochloride;(1RS,2SR,1′SR)-1-(p-Hydroxyphenyl)-2-(1′-methyl-2′-phenoxyethylamino)-1-propanol hydrochloride, mixture of enantiomers;Isoxsuprine hydrochloride
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Color/Form | Crystals from water |
|---|---|
| Taste | Bitter crystals |
| Melting Point | 203-204 °C |
| Solubility | Soluble in ethanol |
| Refractive Index | INDICES OF REFRACTION; ALPHA 1.508; BETA 1.648; GAMMA 1.670 |
| Collision Cross Section | 172.1 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards] |
| Other Experimental Properties | MW: 301.38; mp 102.5-103.5 °C /Isoxsuprine/ |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Environment GHS09 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H410:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P273:Avoid release to the environment. P391:Collect spillage. Hazardous to the aquatic environment P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
| Molecular Weight | 337.8 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 7 |
| Exact Mass | 337.1444713 g/mol |
| Monoisotopic Mass | 337.1444713 g/mol |
| Topological Polar Surface Area | 61.7 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 299 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Isoxsuprine hydrochloride is an alkylbenzene.