Basic information
- CAS
46488-79-3- Standard SMILES
Cc1cccc(C)c1N(C)CCN=C(N)N- InChIKey
QKTIVYNFAOATJT-UHFFFAOYSA-N- Molecular formula
- C12H20N4
- Average molar mass
- 220.31 g/mol
- Monoisotopic mass
- 220.16879665
Names & identifiers
- Preferred name
- Guanidine, (2-(N-methyl-2,6-xylidino)ethyl)-
- IUPAC
- 2-[2-(N,2,6-trimethylanilino)ethyl]guanidine
- English name
- 1-[2-(N-Methyl-2,6-xylidino)ethyl]guanidine
- Molecular formula
- C12H20N4
- Molecular weight
- 220.31
Names & synonyms
(2-(N-Methyl-2,6-xylidino)ethyl)guanidineBRN 265112946488-79-3GUANIDINE, (2-(N-METHYL-2,6-XYLIDINO)ETHYL)-DTXSID00196851RefChem:346717DTXCID40119342N''-{2-[(2,6-Dimethylphenyl)(methyl)amino]ethyl}guanidine1-[2-(N-Methyl-2,6-xylidino)ethyl]guanidineGuanidine, N-[2-[(2,6-dimethylphenyl)methylamino]ethyl]-N-Methyl-N-(2,6-dimethyl-phenyl)-N'-guanyl-aethylendiamin
Database identifiers
- CAS
46488-79-3- PubChem CID
- 39455
- DTXSID
DTXSID00196851- Nikkaji
- J133.892G
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 67.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 225
Physicochemical properties
- Boiling point
- 339.9 · 339.9±44.0 °C(Predicted)
- Density
- 1.08 · 1.08±0.1 g/cm3(Predicted)
- pka
- 13.37 · 13.37±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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