Basic information
- Standard SMILES
COC(CNCc1ccc(Br)cc1)OC- InChIKey
IEMKXFLENZAFAZ-UHFFFAOYSA-N- Molecular formula
- C11H16BrNO2
- Average molar mass
- 274.15 g/mol
- Monoisotopic mass
- 273.03644
Names & identifiers
- Preferred name
- N-(4-Bromobenzyl)-2,2-dimethoxyethanamine
- IUPAC
- N-[(4-bromophenyl)methyl]-2,2-dimethoxyethanamine
Names & synonyms
1036378-89-8N-(4-Bromobenzyl)-2,2-dimethoxyethanamineN-(4-BROMOBENZYL)-2,2-DIMETHOXYETHYLAMINEN-[(4-bromophenyl)methyl]-2,2-dimethoxyethanamineMFCD12148381N-(4-bromobenzyl)-2,2-dimethoxyethan-1-amineSCHEMBL1411918IEMKXFLENZAFAZ-UHFFFAOYSA-NAC2774AKOS008988770AB65352SS-5161
Show more names
SY016083DB-021550CS-0325420(4-Bromo-benzyl)-(2,2-dimethoxy-ethyl)-amineN-[(4-bromophenyl)methyl]-2,2-dimethoxy-ethanamine
Database identifiers
- PubChem CID
- 59226241
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 157
Related reactions
7 records
Compound notes
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