4-(2-Aminoethyl)-N,N-dimethylbenzeneacetamide
Basic information
- CAS
124499-22-5- Standard SMILES
CN(C)C(=O)Cc1ccc(CCN)cc1- InChIKey
ZHIUNNNQUPYJKN-UHFFFAOYSA-N- Molecular formula
- C12H18N2O
- Average molar mass
- 206.28 g/mol
- Monoisotopic mass
- 206.1419132
Names & identifiers
- Preferred name
- 4-(2-Aminoethyl)-N,N-dimethylbenzeneacetamide
- IUPAC
- 2-[4-(2-aminoethyl)phenyl]-N,N-dimethylacetamide
- English name
- 2-[4-(2-Amino-ethyl)-phenyl]-N,N-dimethyl-acetamide
- Molecular formula
- C12H18N2O
- Molecular weight
- 206.28
Names & synonyms
124499-22-5RefChem:2870774-(2-Aminoethyl)-N,N-dimethylbenzeneacetamide2-[4-(2-aminoethyl)phenyl]-N,N-dimethylacetamide2-[4-(2-AMINO-ETHYL)-PHENYL]-N,N-DIMETHYL-ACETAMIDEMFCD04114530Benzeneacetamide, 4-(2-aminoethyl)-N,N-dimethyl-DTXSID90567314AKOS022179630AB185222-[4-(2-aminoethyl)phenyl]-N,N-dimethyl-acetamide
Database identifiers
- CAS
124499-22-5- PubChem CID
- 15036610
- DTXSID
DTXSID90567314- EC Number
- 808-842-8
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 196
Physicochemical properties
- Boiling point
- 359 · 359.0±30.0 °C(Predicted)
- Density
- 1.051 · 1.051±0.06 g/cm3(Predicted)
- pka
- 9.89 · 9.89±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H317
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-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
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 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 CategoriesSkin Sens. 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H317
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Suppliers
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Related reactions
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Compound notes
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