Basic information
- CAS
24332-81-8- Standard SMILES
CC1(C#N)CC2CC1C1OC21- InChIKey
RZRHKOZGVGKBFC-UHFFFAOYSA-N- Molecular formula
- C9H11NO
- Average molar mass
- 149.19 g/mol
- Monoisotopic mass
- 149.08406397
Names & identifiers
- Preferred name
- 2-Norbornanecarbonitrile, 5,6-epoxy-2-methyl-, stereoisomer
- IUPAC
- 6-methyl-3-oxatricyclo[3.2.1.02,4]octane-6-carbonitrile
- English name
- 2-Norbornanecarbonitrile,5,6-epoxy-2-methyl-,stereoisomer(8CI)
- Molecular formula
- C9H11NO
- Molecular weight
- 149.19
Names & synonyms
24332-81-82-Norbornanecarbonitrile, 5,6-epoxy-2-methyl-, stereoisomerDTXSID0011902506-Methyl-3-oxatricyclo[3.2.1.0~2,4~]octane-6-carbonitrile2-Norbornanecarbonitrile,5,6-epoxy-2-methyl-,stereoisomer(8CI)
Database identifiers
- CAS
24332-81-8- PubChem CID
- 3573449
- DTXSID
DTXSID001190250
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 266
Physicochemical properties
- Boiling point
- 267.5 · 267.5±23.0 °C(Predicted)
- Density
- 1.2 · 1.20±0.1 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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