3-(2,3-Dimethylphenyl)pyridin-4-amine
Basic information
- CAS
1125448-06-7- Standard SMILES
Cc1cccc(-c2cnccc2N)c1C- InChIKey
BPUQOJNSIAPWFL-UHFFFAOYSA-N- Molecular formula
- C13H14N2
- Average molar mass
- 198.26 g/mol
- Monoisotopic mass
- 198.11569846
Names & identifiers
- Preferred name
- 3-(2,3-Dimethylphenyl)pyridin-4-amine
- IUPAC
- 3-(2,3-dimethylphenyl)pyridin-4-amine
- English name
- 3-(2,3-diMethylphenyl)pyridin-4-aMine
- Molecular formula
- C13H14N2
- Molecular weight
- 198.26
Names & synonyms
3-(2,3-dimethylphenyl)pyridin-4-amine1125448-06-7DTXSID70653800AKOS013408274SB54666DB-3037064-Pyridinamine, 3-(2,3-dimethylphenyl)-
Database identifiers
- CAS
1125448-06-7- PubChem CID
- 39754138
- DTXSID
DTXSID70653800
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 205
Physicochemical properties
- Boiling point
- 354.4 · 354.4±37.0 °C(Predicted)
- Density
- 1.084 · 1.084±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 8.76 · 8.76±0.12(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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