3-(4-Iodoanilino)-1-(2-naphthyl)-1-propanone
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Basic information
- CAS
477320-57-3- Standard SMILES
O=C(CCNc1ccc(I)cc1)c1ccc2ccccc2c1- InChIKey
LXHZPZUYVDLDPI-UHFFFAOYSA-N- Molecular formula
- C19H16INO
- Average molar mass
- 401.2 g/mol
- Monoisotopic mass
- 401.02766
Names & identifiers
- Preferred name
- 3-(4-Iodoanilino)-1-(2-naphthyl)-1-propanone
- IUPAC
- 3-(4-iodoanilino)-1-naphthalen-2-ylpropan-1-one
- English name
- 3-(4-iodoanilino)-1-(2-naphthyl)-1-propanone
- Molecular formula
- C19H16INO
- Molecular weight
- 401.241
Names & synonyms
477320-57-33-(4-iodoanilino)-1-(2-naphthyl)-1-propanoneRefChem:493155646-693-93-((4-Iodophenyl)amino)-1-(naphthalen-2-yl)propan-1-one3-(4-iodoanilino)-1-naphthalen-2-ylpropan-1-one3-[(4-iodophenyl)amino]-1-(naphthalen-2-yl)propan-1-oneAKOS005108404JS-2458
Database identifiers
- CAS
477320-57-3- PubChem CID
- 4576233
- EC Number
- 646-693-9
Properties
Computed structural propertiesFilling in
- XLogP
- 5.7
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 364
Physicochemical properties
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410
- Precautionary statements
- 273 · P273-P391-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H410
- Precautionary statements
- P273-P391-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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