Basic information
- CAS
780690-91-7- Standard SMILES
CCOc1ccc(CC(=N)N(C)C)cc1- InChIKey
JSUGKOPTZACVFC-UHFFFAOYSA-N- Molecular formula
- C12H18N2O
- Average molar mass
- 206.28 g/mol
- Monoisotopic mass
- 206.1419132
Names & identifiers
- Preferred name
- 2-(4-ethoxyphenyl)-N,N-dimethylethanimidamide
- IUPAC
- 2-(4-ethoxyphenyl)-N,N-dimethylethanimidamide
- English name
- Benzeneethanimidamide, 4-ethoxy-N,N-dimethyl- (9CI)
- Molecular formula
- C12H18N2O
- Molecular weight
- 206.28
Names & synonyms
780690-91-72-(4-ethoxyphenyl)-N,N-dimethylethanimidamideDTXSID80703789(4-Ethoxyphenyl)-N,N-dimethylethanimidamideDB-285389BENZENEETHANIMIDAMIDE, 4-ETHOXY-N,N-DIMETHYL-Benzeneethanimidamide, 4-ethoxy-N,N-dimethyl- (9CI)
Database identifiers
- CAS
780690-91-7- PubChem CID
- 53471902
- DTXSID
DTXSID80703789
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 196
Physicochemical properties
- Boiling point
- 296.743 · 296.743±42.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.988 · 0.988±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 12.452 · 12.452±0.50(predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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