CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Solid |
|---|---|
| Color/Form | Hard, colorless crystals |
| Odor | ODORLESS |
| Melting Point | 70 °C |
| Solubility | 550 mg/L (at 25 °C) |
| LogP | 1.31 |
| LogS | -2.63 |
| Stability/Shelf Life | Isosorbide dinitrate injections are colorless and stable in the intact ampuls or bottles when stored at room temperature. |
| Optical Rotation | Specific optical rotation: +135 deg @ 20 °C/D (alcohol, 1%) |
| Collision Cross Section | 151.6 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards] |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02  Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P230:Keep wetted with … P233:Keep container tightly closed. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P380+P375:in case of fire: Evacuate area. Fight fire remotely due to the risk of explosion. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
| Molecular Weight | 236.14 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 2 |
| Exact Mass | 236.02806522 g/mol |
| Monoisotopic Mass | 236.02806522 g/mol |
| Topological Polar Surface Area | 129 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 268 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| 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
Isosorbide dinitrate is a nitrate ester and a glucitol derivative. It has a role as a vasodilator agent and a nitric oxide donor.