Bicyclo[2.2.2]oct-5-ene-2,3-dicarbonitrile
Basic information
- CAS
62249-52-9- Standard SMILES
N#CC1C2C=CC(CC2)C1C#N- InChIKey
XNFWRFPWBZBKIW-UHFFFAOYSA-N- Molecular formula
- C10H10N2
- Average molar mass
- 158.2 g/mol
- Monoisotopic mass
- 158.08439833
Names & identifiers
- Preferred name
- Bicyclo[2.2.2]oct-5-ene-2,3-dicarbonitrile
- IUPAC
- bicyclo[2.2.2]oct-5-ene-2,3-dicarbonitrile
- English name
- Bicyclo[2.2.2]oct-5-ene-2,3-dicarbonitrile
- Molecular formula
- C10H10N2
- Molecular weight
- 158.2
Names & synonyms
Bicyclo[2.2.2]oct-5-ene-2,3-dicarbonitrileNIOSH/DT8038000NSC 2920362249-52-9DT80380000trans-Bicyclo(2.2.2)oct-5-ene-2,3-dicarbonitrileBicyclo(2.2.2)oct-5-ene-2,3-dicarbonitrile, trans-(1-alpha,2-alpha,3-beta,4-alpha)-Bicyclo(2.2.2)oct-5-ene-2,3-dicarbonitrileBicyclo(2.2.2)oct-5-ene-2,3-dicarbonitrile, (1-alpha,2-alpha,3-beta,4-alpha)-NSC46418DTXSID00286544XNFWRFPWBZBKIW-UHFFFAOYSA-N
Show more names
NSC-46418DB-307638
Database identifiers
- CAS
62249-52-9- PubChem CID
- 240307
- DTXSID
DTXSID00286544- Nikkaji
- J123.992I
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 279
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Compound notes
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