5-Norbornene-2-carbonitrile, mixture of isomers
Product Information
Molecular Formula
C8H9N
Molecular Weight
119.16
Description
5-Norbornene-2-carbonitrile, mixture of isomers (CAS# 95-11-4) is used in method for continuously preparing cyanonorbornene by using microchannel reactor.
Synonyms
bicyclo[2.2.1]hept-5-ene-2-carbonitrile
IUPAC Name
bicyclo[2.2.1]hept-5-ene-2-carbonitrile
SMILES
C1C2CC(C1C=C2)C#N
InChI
InChI=1S/C8H9N/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-4H2
InChI Key
BMAXQTDMWYDIJX-UHFFFAOYSA-N
Boiling Point
82-86 °C (10 mmHg)
Melting Point
41987 °C
Flash Point
150.8 °CF - closed cup
Purity
98 %
Density
0.999 g/cm3
Appearance
Clear, colorless clear liquid
Storage
Keep away from heat, sparks, and flame. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
Refractive Index
n20/D 1.488 (lit.)
LogP
1.72218
Safety Information
Hazards
H302+H312+H332:
Harmful if swallowed.
Harmful in contact with skin.
Harmful if inhaled.
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Harmful if swallowed.
Harmful in contact with skin.
Harmful if inhaled.
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
XLogP3
1.4
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
0
Exact Mass
119.073499291 g/mol
Monoisotopic Mass
119.073499291 g/mol
Topological Polar Surface Area
23.8Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
196
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
3
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| JP-2022029460-A | Release film for molding solid polymer fuel cell components | 2021-11-08 |
| JP-2022040112-A | Laminated film and its manufacturing method and fuel cell manufacturing method | 2021-10-22 |
| CN-113045413-A | Method for preparing single-configuration C-2-position monosubstituted norbornene derivative | 2021-03-16 |
| CN-112390728-A | Method for continuously preparing cyano norbornene by using microchannel reactor | 2020-11-27 |
| WO-2022036044-A1 | Olefinic compositions comprising hydrocarbon resins | 2020-08-13 |
| WO-2022014591-A1 | Curable composition and cured body of same | 2020-07-17 |
| JP-2022016004-A | Polar group-containing olefin copolymer | 2020-07-10 |
| WO-2021220759-A1 | Method for evaluating neural action of test substance, and kit and nerve cell culture container therefor | 2020-04-28 |
| JP-2021171941-A | Multi-layer structure | 2020-04-21 |
| CN-111393832-A | Macromolecular network topological heterogeneous system based on dynamic covalent bonds and application method thereof | 2020-03-27 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 21588009 | 2010-06-26 | 2-(Bicyclo-[2.2.1]hept-5-en-2-yl)-1H-pyrrolo-[2,3-b]pyridine | Acta crystallographica. Section E, Structure reports online |
| 19331369 | 2009-05-01 | Online ESI-MS analysis of reactions under high pressure | Analytical chemistry |
