Basic information
- CAS
52235-20-8- Standard SMILES
CCC(C)(C#N)N=NC(C)(C)C- InChIKey
JZDHUYKBYNFYAB-UHFFFAOYSA-N- Molecular formula
- C9H17N3
- Average molar mass
- 167.25 g/mol
- Monoisotopic mass
- 167.14224756
Names & identifiers
- Preferred name
- 2-(tert-Butylazo)-2-butanenitrile
- IUPAC
- 2-(tert-butyldiazenyl)-2-methylbutanenitrile
- English name
- 2-[(tert-butyl)azo]-2-methylbutyronitrile
- Molecular formula
- C9H17N3
- Molecular weight
- 167.25
Names & synonyms
52235-20-82-((tert-Butyl)azo)-2-methylbutyronitrile2-[(tert-Butyl)azo]-2-methylbutyronitrile2-(tert-Butylazo)-2-butanenitrileEINECS 257-766-643137U6JOPLUAZO 82Butanenitrile, 2-((1,1-dimethylethyl)azo)-2-methyl-Butanenitrile, 2-(2-(1,1-dimethylethyl)diazenyl)-2-methyl-DTXSID20885992Butanenitrile, 2-[(1,1-dimethylethyl)azo]-2-methyl-Butanenitrile, 2-[2-(1,1-dimethylethyl)diazenyl]-2-methyl-
Show more names
2-((1,1-DIMETHYLETHYL)AZO)-2-METHYL-BUTANENITRILE
2-(2-(1,1-DIMETHYLETHYL)DIAZENYL)-2-METHYLBUTANENITRILERefChem:462340DTXCID701025343257-766-62-tert-Butylazo-2-cyanobutane2-(tert-butyldiazenyl)-2-methylbutanenitrileSCHEMBL297008SCHEMBL297009
Database identifiers
- CAS
52235-20-8- PubChem CID
- 103609
- DTXSID
DTXSID20885992- UNII
- 43137U6JOP
- EC Number
- 257-766-6
- Nikkaji
- J133.950H
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 48.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 216
Physicochemical properties
- Boiling point
- 212.6 · 212.6±23.0 °C(Predicted)
- Density
- 0.88 · 0.88±0.1 g/cm3(Predicted)
- FDA UNII
- 43137 U6JOP · 43137U6JOP
- EPA Substance Registry System
- 2 · Butanenitrile, 2-[(1,1-dimethylethyl)azo]-2-methyl- (52235-20-8)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Butanenitrile, 2-[(1,1-dimethylethyl)azo]-2-methyl-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationButanenitrile, 2-[2-(1,1-dimethylethyl)diazenyl]-2-methyl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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