Basic information
- CAS
72928-07-5- Standard SMILES
CC(=CC#N)C1CC2CCC1C2- InChIKey
MABXILJZMXOERV-UHFFFAOYSA-N- Molecular formula
- C11H15N
- Average molar mass
- 161.24 g/mol
- Monoisotopic mass
- 161.12044948
Names & identifiers
- Preferred name
- 2-Butenenitrile, 3-bicyclo[2.2.1]hept-2-yl-
- IUPAC
- 3-(2-bicyclo[2.2.1]heptanyl)but-2-enenitrile
Names & synonyms
2-Butenenitrile, 3-bicyclo[2.2.1]hept-2-yl-DTXSID008883052-Butenenitrile, 3-bicyclo(2.2.1)hept-2-yl-EINECS 277-049-13-BICYCLO[2.2.1]HEPT-2-YL-2-BUTENENITRILE3-Bicyclo(2.2.1)hept-2-yl-2-butenenitrileRefChem:257911DTXCID301027585277-049-172928-07-5MABXILJZMXOERV-UHFFFAOYSA-NNS00060537
Show more names
3-(Bicyclo[2.2.1]heptan-2-yl)but-2-enenitrile
Database identifiers
- CAS
72928-07-5- PubChem CID
- 175292
- DTXSID
DTXSID00888305- EC Number
- 277-049-1
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 255
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Butenenitrile, 3-bicyclo[2.2.1]hept-2-yl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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