Basic information
- CAS
800381-42-4- Standard SMILES
Nc1ccc(C(=O)C=Cc2cccc3ccccc23)cc1- InChIKey
UHGQKIOLVVTZKX-UHFFFAOYSA-N- Molecular formula
- C19H15NO
- Average molar mass
- 273.3 g/mol
- Monoisotopic mass
- 273.1153641
Names & identifiers
- Preferred name
- 1-(4-Aminophenyl)-3-(naphthalen-1-yl)prop-2-en-1-one
- IUPAC
- 1-(4-aminophenyl)-3-naphthalen-1-ylprop-2-en-1-one
- English name
- (2E)-1-(4-aminophenyl)-3-(1-naphthyl)prop-2-en-1-one
- Molecular formula
- C19H15NO
- Molecular weight
- 273.33
Names & synonyms
800381-42-41-(4-Aminophenyl)-3-(naphthalen-1-yl)prop-2-en-1-oneDTXSID30695645RefChem:224797DTXCID306463942-Propen-1-one, 1-(4-aminophenyl)-3-(1-naphthalenyl)-1-(4-aminophenyl)-3-naphthalen-1-ylprop-2-en-1-one1-(4-aminophenyl)-3-(naphthalen-1-yl)-2-propen-1-one(2E)-1-(4-aminophenyl)-3-(1-naphthyl)prop-2-en-1-one(E)-1-(4-aminophenyl)-3-(1-naphthyl)prop-2-en-1-one(E)-1-(4-aminophenyl)-3-naphthalen-1-ylprop-2-en-1-one(E)-1-(4-aminophenyl)-3-naphthalen-1-yl-prop-2-en-1-one
Database identifiers
- CAS
800381-42-4- PubChem CID
- 53405698
- DTXSID
DTXSID30695645
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 381
Physicochemical properties
- Boiling point
- 513.2 · 513.2±50.0 °C(Predicted)
- Density
- 1.208 · 1.208±0.06 g/cm3(Predicted)
- pka
- 1.97 · 1.97±0.10(Predicted)
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers2 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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