4-[[Methoxymethyl(methyl)amino]diazenyl]benzonitrile
Basic information
- CAS
90476-18-9- Standard SMILES
COCN(C)N=Nc1ccc(C#N)cc1- InChIKey
PPZSBQVXIIXROR-UHFFFAOYSA-N- Molecular formula
- C10H12N4O
- Average molar mass
- 204.23 g/mol
- Monoisotopic mass
- 204.10111102
Names & identifiers
- Preferred name
- 4-[[Methoxymethyl(methyl)amino]diazenyl]benzonitrile
- IUPAC
- 4-[[methoxymethyl(methyl)amino]diazenyl]benzonitrile
Names & synonyms
NSC37208790476-18-9DTXSID20321224NSC-3720874-[(1E)-3-(Methoxymethyl)-3-methyltriaz-1-en-1-yl]benzonitrile
Database identifiers
- CAS
90476-18-9- PubChem CID
- 340889
- DTXSID
DTXSID20321224
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 61 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 249
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Related reactions
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Compound notes
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