chempirical

Bicyclo[2.2.1]hept-5-ene-2-carbonitrile

C8H9NCAS 95-11-4119.17 g/mol

Open in Covalent MOL file
N
AlkeneNitrile

Properties

Molecular formula
C8H9N
Molar mass
119.17 g/mol
Exact mass
119.0735 Da
Density
1.0066 g/mL (at 25 °C)
Melting point
13 °C
Boiling point
80–85 °C (at 11 Torr)
logP
1.72Crippen estimate
Polar surface area
23.8 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
95-11-4
SMILES
N#CC1CC2C=CC1C2
InChIKey
BMAXQTDMWYDIJX-UHFFFAOYSA-N
InChI
InChI=1S/C8H9N/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-4H2

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

9 names
  • 5-Norbornene-2-carbonitrile
  • 5-Cyanobicyclo[2.2.1]hept-2-ene
  • 5-Cyano-2-norbornene
  • 2-Cyano-5-norbornene
  • 2-Cyanobicyclo[2.2.1]hept-5-ene
  • Bicyclo[2.2.1]-5-hepten-2-carbonitrile
  • Norbornenecarbonitrile
  • 5-Cyanonorbornene
  • Bicyclo(2.2.1)hept-5-ene-2-carbonitrile

Work with Bicyclo[2.2.1]hept-5-ene-2-carbonitrile

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-Norbornen-2-ol13080-90-541 % similar Vinyl norbornene3048-64-441 % similar Bicyclo[2.2.1]hept-5-ene-2-carboxaldehyde5453-80-541 % similar 5-Norbonene-2-methanamine95-10-338 % similar Bicyclo[2.2.1]hept-5-ene-2-methanol95-12-538 % similar Methyl (8,9,10-trinorborn-5-en-2-yl) ketone5063-03-638 % similar Bicyclo[2.2.1]hept-5-ene-2-carbonyl chloride27063-48-534 % similar 5-Norbornen-2-yl acetate6143-29-934 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Ethenyl-6-methylpyridine1122-70-9 2-Methyl-5-vinylpyridine140-76-1 4-Aminostyrene1520-21-4 3-Aminostyrene15411-43-5 Isoindoline496-12-8 Indoline496-15-1 6,7-Dihydro-5H-cyclopenta[b]pyridine533-37-9 Bicyclo[4.2.0]octa-1,3,5-trien-3-amine55716-66-0

Elsewhere

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