Basic information
- CAS
5349-31-5- Standard SMILES
CCNC(=O)C(C)Br- InChIKey
DOQUSEJOWOMUEH-UHFFFAOYSA-N- Molecular formula
- C5H10BrNO
- Average molar mass
- 180.04 g/mol
- Monoisotopic mass
- 178.99458
Names & identifiers
- Preferred name
- 2-Bromo-n-ethylpropanamide
- IUPAC
- 2-bromo-N-ethylpropanamide
- English name
- Propanamide,2-bromo-N-ethyl-
- Molecular formula
- C5H10BrNO
- Molecular weight
- 180.04
Names & synonyms
2-bromo-n-ethylpropanamide5349-31-5NSC12072-BROMO-N-ETHYLPROPIONAMIDEMFCD15205180SCHEMBL9491609SCHEMBL27753334ALBB-032028NSC-1207AKOS016052378LS-11756DS-012265
Show more names
2-Bromo-N-ethyl-propionamidePropanamide,2-bromo-N-ethyl-
H46106
Database identifiers
- CAS
5349-31-5- PubChem CID
- 219652
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 84.5
Physicochemical properties
- Melting point
- 60 °C · 60 °C
- Boiling point
- 114 · 114-115 °C(Press: 16 Torr)
- Density
- 1.378 · 1.378±0.06 g/cm3(Predicted)
- pka
- 14.14 · 14.14±0.46(Predicted)
Chemistry & industry
Suppliers2 total
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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