111-94-4
Product Name:
3,3'-IMINODIPROPIONITRILE
Formula:
C6H9N3
Synonyms:
Bis(2-cyanoethyl)amine
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | 3,3'-iminodipropionitrile is a clear colorless liquid. (NTP, 1992) |
|---|---|
| Color/Form | Colorless liquid |
| Boiling Point | 343 °F at 10 mmHg (NTP, 1992) |
| Melting Point | 21 °F (NTP, 1992) |
| Flash Point | 230 °F (NTP, 1992) |
| Solubility | greater than or equal to 100 mg/mL at 68 °F (NTP, 1992) |
| Density | 1.02 at 68 °F (NTP, 1992) - Denser than water; will sink |
| Vapor Density | 3.3 (NTP, 1992) - Heavier than air; will sink (Relative to Air) |
| Vapor Pressure | 1 mmHg at 284 °F (NTP, 1992) |
| LogP | log Kow= -1.34 |
| Stability/Shelf Life | A storage hazard, may explode in a sealed container. |
| Decomposition | When heated to decomposition it emits toxic fumes of NOx and hydrogen cyanide /nitrogen oxides and cyanides/. |
| Refractive Index | Index of refraction: 1.4700 @ 20 °C/D |
| Dissociation Constants | pKa= 5.26 (conjugate acid) |
| Other Experimental Properties | Moisture sensitive |
| Chemical Classes | Nitrogen Compounds -> Nitriles |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Corrosion Corrosives GHS05  Skull and Crossbones Acute Toxicity GHS06  Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H301:Acute toxicity,oral H315:Skin corrosion/irritation H318:Serious eye damage/eye irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P280:Wear protective gloves/protective clothing/eye protection/face protection. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P405:Store locked up. |
COMPUTED DESCRIPTORS
| Molecular Weight | 123.16 g/mol |
|---|---|
| XLogP3 | -0.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 123.079647300 g/mol |
| Monoisotopic Mass | 123.079647300 g/mol |
| Topological Polar Surface Area | 59.6 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 126 |
| 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
3,3'-iminodipropionitrile is a clear colorless liquid. (NTP, 1992)