N,N'-Ethylidenebis(2-bromoacetamide)
Basic information
- CAS
4960-81-0- Standard SMILES
CC(NC(=O)CBr)NC(=O)CBr- InChIKey
LXQOYTPYCRHHCB-UHFFFAOYSA-N- Molecular formula
- C6H10Br2N2O2
- Average molar mass
- 301.96 g/mol
- Monoisotopic mass
- 299.9109
Names & identifiers
- Preferred name
- N,N'-Ethylidenebis(2-bromoacetamide)
- IUPAC
- 2-bromo-N-[1-[(2-bromoacetyl)amino]ethyl]acetamide
- English name
- N,N'-ethylidenebis(2-bromoacetamide)
- Molecular formula
- C6H10Br2N2O2
- Molecular weight
- 301.96
Names & synonyms
N,N'-Ethylidenebis(2-bromoacetamide)N,N-Ethylidenebis(2-bromoacetamide)2-bromo-N-[1-[(2-bromoacetyl)amino]ethyl]acetamideDTXSID00964294FB173277NS00045681N,N'-(Ethane-1,1-diyl)bis(bromoethanimidic acid)N,N'-(Ethane-1,1-diyl)bis(2-bromoethanimidic acid)Einecs 225-603-81,2-Bis(bromoacetylamino)ethaneAcetamide, N,N'-1,2-ethanediylbis[2-bromo-N,N'-(Ethane-1,2-diyl)bis(2-bromoacetamide)
Database identifiers
- CAS
4960-81-0- PubChem CID
- 78663
- DTXSID
DTXSID00964294- EC Number
- 225-603-8
- Nikkaji
- J203.208B
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 157
Physicochemical properties
- Melting point
- 150 °C · 150 °C
- Boiling point
- 514.4 · 514.4±45.0 °C(Predicted)
- Density
- 1.821 · 1.821±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Storage temp. 2-8°C
- pka
- 12.89 · 12.89±0.46(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
Uses1,2-Bis(bromoacetylamino)ethane is a reagent used in the synthesis of foldamer mimics which provide effective peptide mimics in physiological environments against bacterial infection.
Upstream & downstream products
Upstream raw materials
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