68411-90-5
Product Name:
Hexanedinitrile, hydrogenated, high-boiling fraction
Formula:
C6H8N2
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Adiponitrile appears as a colorless to light yellow liquid which is fairly soluble and is less dense than water. Contact may irritate skin, eyes and mucous membranes. May be toxic by ingestion, inhalation and skin absorption. |
|---|---|
| Color/Form | NEEDLES FROM ETHER |
| Odor | Practically odorless. |
| Boiling Point | 563 °F at 760 mmHg (EPA, 1998) |
| Melting Point | 36.1 °F (EPA, 1998) |
| Flash Point | 199.4 °F (EPA, 1998) |
| Solubility | 50 to 100 mg/mL at 73 °F (NTP, 1992) |
| Density | 0.965 at 68 °F (EPA, 1998) - Less dense than water; will float |
| Vapor Density | 3.73 (EPA, 1998) - Heavier than air; will sink (Relative to Air) |
| Vapor Pressure | 2 mmHg at 246 °F (NTP, 1992) |
| LogP | log Kow= -0.32 |
| Autoignition Temperature | 1022 °F (USCG, 1999) |
| Decomposition | WHEN HEATED TO DECOMP RELEASES VAPORS CONTAINING HYDROCYANIC ACID. |
| Viscosity | 9.1 cP @ 20 °C; 2.6 cP @ 70 °C |
| Heat of Combustion | -40.4X10+6 J/kg |
| Heat of Vaporization | 70.4X10+4 J/kg |
| Refractive Index | Index of refraction: 1.4380 @ 20 °C/D |
| Kovats Retention Index | 1090 |
| Other Experimental Properties | Vap: 2 mm Hg @ 119 °C |
| Chemical Classes | Nitrogen Compounds -> Nitriles |
COMPUTED DESCRIPTORS
| Molecular Weight | 108.14 g/mol |
|---|---|
| XLogP3 | -0.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 108.068748264 g/mol |
| Monoisotopic Mass | 108.068748264 g/mol |
| Topological Polar Surface Area | 47.6 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 113 |
| 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
Adiponitrile appears as a colorless to light yellow liquid which is fairly soluble and is less dense than water. Contact may irritate skin, eyes and mucous membranes. May be toxic by ingestion, inhalation and skin absorption.