2-Methyl-2-nitropropanenitrile
Basic information
- CAS
18992-13-7- Standard SMILES
CC(C)(C#N)[N+](=O)[O-]- InChIKey
DCRYEPXLTRMYOW-UHFFFAOYSA-N- Molecular formula
- C4H6N2O2
- Average molar mass
- 114.1 g/mol
- Monoisotopic mass
- 114.04292744
Names & identifiers
- Preferred name
- 2-Methyl-2-nitropropanenitrile
- IUPAC
- 2-methyl-2-nitropropanenitrile
- English name
- 2-Methyl-2-nitropropionitrile
- Molecular weight
- 0
Names & synonyms
2-methyl-2-nitropropanenitrilePropionitrile, 2-methyl-2-nitro-18992-13-7DTXSID90172422RefChem:1063686DTXCID3094913USAF A-13564alpha-Methyl-alpha-nitropropionitrilePropionitrile, alpha-methyl-alpha-nitro-2-cyano-2-nitro-propane2-methyl-2-nitro-propionitrileSCHEMBL3293996
Show more names
2-Methyl-2-nitropropionitrile
Database identifiers
- CAS
18992-13-7- PubChem CID
- 87884
- DTXSID
DTXSID90172422- Nikkaji
- J51.103J
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 147
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Related reactions
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Compound notes
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