N,N-Dimethyl-4-(4-phenoxyquinazolin-2-yl)aniline
Basic information
- CAS
79916-51-1- Standard SMILES
CN(C)c1ccc(-c2nc(Oc3ccccc3)c3ccccc3n2)cc1- InChIKey
FUZVMZFXKNHVJY-UHFFFAOYSA-N- Molecular formula
- C22H19N3O
- Average molar mass
- 341.4 g/mol
- Monoisotopic mass
- 341.15281224
Names & identifiers
- Preferred name
- N,N-Dimethyl-4-(4-phenoxyquinazolin-2-yl)aniline
- IUPAC
- N,N-dimethyl-4-(4-phenoxyquinazolin-2-yl)aniline
- English name
- N,N-dimethyl-4-(4-phenoxyquinazolin-2-yl)aniline
- Molecular formula
- C22H19N3O
- Molecular weight
- 341.41
Names & synonyms
N,N-Dimethyl-4-(4-phenoxyquinazolin-2-yl)aniline79916-51-1EINECS 279-350-3SCHEMBL5710053FUZVMZFXKNHVJY-UHFFFAOYSA-NDTXSID801000837NS00061114N,N-Dimethyl-4-(4-phenoxy-2-quinazolinyl)anilineBenzenamine,N,N-dimethyl-4-(4-phenoxy-2-quinazolinyl)-
Database identifiers
- CAS
79916-51-1- PubChem CID
- 3018899
- DTXSID
DTXSID801000837- EC Number
- 279-350-3
- Nikkaji
- J320.207K
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 429
Physicochemical properties
- Boiling point
- 445.8 · 445.8±41.0 °C(Predicted)
- Density
- 1.202 · 1.202±0.06 g/cm3(Predicted)
- pka
- 2.81 · 2.81±0.50(Predicted)
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Related reactions
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Compound notes
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