N-(4-aminophenyl)-3-methylbutanamide
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Basic information
- CAS
189576-50-9- Standard SMILES
CC(C)CC(=O)Nc1ccc(N)cc1- InChIKey
ACHJACAEYOYEBF-UHFFFAOYSA-N- Molecular formula
- C11H16N2O
- Average molar mass
- 192.26 g/mol
- Monoisotopic mass
- 192.12626314
Names & identifiers
- Preferred name
- N-(4-aminophenyl)-3-methylbutanamide
- IUPAC
- N-(4-aminophenyl)-3-methylbutanamide
- English name
- N-(4-AMINOPHENYL)-3-METHYLBUTANAMIDE
- Molecular formula
- C11H16N2O
- Molecular weight
- 192.26
Names & synonyms
N-(4-aminophenyl)-3-methylbutanamide189576-50-9DTXSID90359357RefChem:361733DTXCID20310411848-573-3MFCD00504117Butanamide, N-(4-aminophenyl)-3-methyl-SCHEMBL7655640PHA57650SBB080088STL062268
Show more names
AKOS BBB/531AKOS BBV-010195N-(4-aminophenyl)-3-methylbutanamide(SALTDATA: FREE)
AKOS000104339N-(4-aminophenyl)-3-methyl-butanamideBS-35830ST45050658EN300-29401F309994Z57442166
Database identifiers
- CAS
189576-50-9- PubChem CID
- 960630
- DTXSID
DTXSID90359357- EC Number
- 848-573-3
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- Boiling point
- 306.7 · 306.7±15.0 °C(Predicted)
- Density
- 1.1 · 1.100±0.06 g/cm3(Predicted)
- pka
- 14.75 · 14.75±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, 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.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H335-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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