N,N-Dimethylhydrocinnamide
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Basic information
- CAS
5830-31-9- Standard SMILES
CN(C)C(=O)CCc1ccccc1- InChIKey
FDBVFKPSUNQAHK-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- N,N-Dimethylhydrocinnamide
- IUPAC
- N,N-dimethyl-3-phenylpropanamide
- English name
- N,N-dimethylhydrocinnamide
- Molecular formula
- C11H15NO
- Molecular weight
- 177.24
Names & synonyms
5830-31-9N,N-DimethylhydrocinnamideN,N-DmhcDTXSID10207028RefChem:926503DTXCID10129519N,N-Dimethyl-3-phenylpropanamideBenzenepropanamide, N,N-dimethyl-Hydrocinnamamide, N,N-dimethyl-N,N-Dimethyl-3-phenylpropionamideSCHEMBL3366949SCHEMBL5475015
Show more names
N,N-DimethylbenzenepropanamideN,N-Dimethylbenzenepropionamide
SCHEMBL20553870SCHEMBL27841533N,N-dimethyl-3-phenyl propionamideN,N-dimethyl-3-phenyl-propionamideN,N-Dimethyl-3-phenylpropanamide #AKOS003556770HS-6974ST45054574
Database identifiers
- CAS
5830-31-9- PubChem CID
- 64816
- DTXSID
DTXSID10207028- Nikkaji
- J113.550C
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 159
Physicochemical properties
- Melting point
- 62 · 62-63 °C
- Boiling point
- 294.7 · 294.7±19.0 °C(Predicted)
- Density
- 1.006 · 1.006±0.06 g/cm3(Predicted)
- pka
- -0.5 · -0.50±0.70(Predicted)
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Related reactions
1 records
Compound notes
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