33820-53-0
Product Name:
ISOPROPALIN
Formula:
C15H23N3O4
Synonyms:
4-Isopropyl-2,6-dinitro-N,N-dipropylaniline
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CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Red-orange; liquid; [HSDB] |
|---|---|
| Color/Form | Red-orange liquid |
| Solubility | In water at 25 °C, 0.1 mg/l. In acetone, hexane, benzene, chloroform, diethyl ether, acetonitrile, and methanol, all > 1 kg/l at 25 °C. |
| Vapor Pressure | 0.00003 [mmHg] |
| Stability/Shelf Life | Susceptible to decomposition by UV irradiation. |
| Decomposition | Toxic fumes are emitted when heated to decomposition. |
| Corrosivity | Non-corrosive |
| Kovats Retention Index | 2027 2034 2026.8 2019.9 2021.3 2029.8 2028 |
| Other Experimental Properties | Decomposed by UV light. |
| Chemical Classes | Pesticides -> Herbicides, Nitroaromatic |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02  Environment GHS09 |
| GHS Hazard Statements |
H226:Flammable liquids H410:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P233:Keep container tightly closed. P240:Ground/bond container and receiving equipment. P241:Use explosion-proof electrical/ventilating/lighting/…/equipment. P242:Use only non-sparking tools. P273:Avoid release to the environment. |
COMPUTED DESCRIPTORS
| Molecular Weight | 309.36 g/mol |
|---|---|
| XLogP3 | 5.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 309.16885622 g/mol |
| Monoisotopic Mass | 309.16885622 g/mol |
| Topological Polar Surface Area | 94.9 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 348 |
| 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
Isopropalin is a C-nitro compound.