CHEMICAL AND PHYSICAL PROPERTIES
Color/Form | CRYSTALS FROM BENZENE + TOLUENE |
---|---|
Odor | ODORLESS |
Taste | PRACTICALLY TASTELESS |
Melting Point | 89-91 °C |
Solubility | READILY SOL IN 95% ETHANOL, ACETONE, ETHYL ACETATE; FAIRLY READILY SOL IN DIOXANE; ALMOST INSOL IN COLD WATER, BENZENE, CYCLOHEXANE |
Stability/Shelf Life | STABLE IN LIGHT, AIR, AND AT ORDINARY TEMP. |
Kovats Retention Index | 1695 1677 |
COMPUTED DESCRIPTORS
Molecular Weight | 245.66 g/mol |
---|---|
XLogP3 | 1.2 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 6 |
Exact Mass | 245.0454856 g/mol |
Monoisotopic Mass | 245.0454856 g/mol |
Topological Polar Surface Area | 81.8 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 219 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Chlorphenesin carbamate is the carbamate ester of the primary hydroxy group of chlorphenesin. A centrally acting skeletal muscle relaxant, it is used in the symptomatic treatment of painful muscle spasm. It has a role as a muscle relaxant. It is a carbamate ester, a member of monochlorobenzenes and a secondary alcohol. It is functionally related to a chlorphenesin and a carbamic acid.