3-bromo-N-[(3-bromopropanoylamino)methyl]propanamide
Basic information
- CAS
89891-40-7- Standard SMILES
O=C(CCBr)NCNC(=O)CCBr- InChIKey
ARAAKZVNWNKJOM-UHFFFAOYSA-N- Molecular formula
- C7H12Br2N2O2
- Average molar mass
- 315.99 g/mol
- Monoisotopic mass
- 313.92655
Names & identifiers
- Preferred name
- 3-bromo-N-[(3-bromopropanoylamino)methyl]propanamide
- IUPAC
- 3-bromo-N-[(3-bromopropanoylamino)methyl]propanamide
- English name
- 3-bromo-N-[(3-bromopropanoylamino)methyl]propanamide
- Molecular formula
- C7H12Br2N2O2
- Molecular weight
- 315.99
Names & synonyms
89891-40-73-bromo-N-[(3-bromopropanoylamino)methyl]propanamideNSC57846DTXSID40288845NSC-57846Propanamide,N'-methylenebis[3-bromo-Propionamide,N'-methylenebis(3-bromo-N,N'-Methylenebis(3-bromopropanamide)Propionamide, N,N'-methylenebis[3-bromo- (7CI)
Database identifiers
- CAS
89891-40-7- PubChem CID
- 245671
- DTXSID
DTXSID40288845
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 158
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Compound notes
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