CHEMICAL AND PHYSICAL PROPERTIES
Color/Form | Crystals from water |
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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/ |
COMPUTED DESCRIPTORS
Molecular Weight | 337.8 g/mol |
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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.