Basic information
- CAS
53819-95-7- Standard SMILES
ONc1ccc(/C=C/c2ccccc2)cc1- InChIKey
NERSJRGIHYMPEP-VOTSOKGWSA-N- Molecular formula
- C14H13NO
- Average molar mass
- 211.26 g/mol
- Monoisotopic mass
- 211.09971404
Names & identifiers
- Preferred name
- trans-N-Hydroxy-4-aminostilbene
- IUPAC
- N-[4-[(E)-2-phenylethenyl]phenyl]hydroxylamine
- English name
- N-[(E)-p-Styrylphenyl]hydroxylamine
- Molecular formula
- C14H13NO
- Molecular weight
- 211.26
Names & synonyms
60462-51-3trans-N-Hydroxy-4-aminostilbenetrans-N-(p-Styrylphenyl)hydroxylaminetrans-N-(4-Styrylphenyl)hydroxylamineHydroxylamine, N-(p-styrylphenyl)-, (E)N-Hydroxy-4-(2-phenylethenyl)benzenamineBenzenamine, N-hydroxy-4-(2-phenylethenyl)-CHEMBL313092N-hydroxy-4-amino-trans-stilbeneN-[(e)-p-styrylphenyl ]hydroxylamine53819-95-7DB-320654
Show more names
N-[(E)-p-Styrylphenyl]hydroxylamineBenzenamine, N-hydroxy-4-[(1E)-2-phenylethenyl]-
Database identifiers
- CAS
53819-95-7、60462-51-3- PubChem CID
- 6436738
- ChEMBL
CHEMBL313092- Nikkaji
- J61.442D
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 213
Physicochemical properties
- Boiling point
- 350.95 °C · 350.95°C (rough estimate)
- Density
- 1.0694 · 1.0694 (rough estimate)
- refractive index
- 1.578 · 1.5780 (estimate)
- pka
- 8.88 · 8.88±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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