Basic information
- CAS
14383-60-9- Standard SMILES
CC(=O)NC(C)Cc1ccccc1- InChIKey
YPKBVWZHVTZSPU-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- Acetylamphetamine
- IUPAC
- N-(1-phenylpropan-2-yl)acetamide
- English name
- N-acetylamphetamine
- Molecular formula
- C11H15NO
- Molecular weight
- 177.24
Names & synonyms
Show more names
Database identifiers
- CAS
14383-60-9- PubChem CID
- 26660
- ChEMBL
CHEMBL1588171- ChEBI
CHEBI:191146- EC Number
- 111-691-4
- Nikkaji
- J15.225K
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 161
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 67 °C · 67 °C
- Boiling point
- 180 · 180-185 °C(Press: 13 Torr)
- Density
- 0.995 · 0.995±0.06 g/cm3(Predicted)
- pka
- 16.15 · 16.15±0.46(Predicted)
Safety & regulation
GHS classification
GHS Classification
Danger
H300+H330 (100%): Fatal if swallowed or if inhaled [Danger Acute toxicity, oral; acute toxicity, inhalation];H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral];H330 (100%): Fatal if inhaled [Danger Acute toxicity, inhalation];H336 (100%): May cause drowsiness or dizziness [Warning Specific target organ toxicity, single exposure; Narcotic effects];H361fd (100%): Suspected of damaging fertility; Suspected of damaging the unborn child [Warning Reproductive toxicity];H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]
P203, P260, P261, P264, P270, P271, P280, P284, P301+P316, P304+P340, P316, P318, P319, P320, P321, P330, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Chemistry & industry
Applications
UsesN-Acetylamphetamine is a building block used in various chemical synthesis. It can also be used in the study of effects of acetylated derivatives of some sympathomimetic amines on the acute toxicity, locomotor activity and barbiturate anesthesia time in mice.
Suppliers1 total
Additional notes
DefinitionChEBI: N-acetylamphetamine is a member of amphetamines.
Related reactions
Compound notes
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