Basic information
- Standard SMILES
Cc1cc(OCCN)cc(C)c1Br- InChIKey
JQYBSJIYMTZMKC-UHFFFAOYSA-N- Molecular formula
- C10H14BrNO
- Average molar mass
- 244.13 g/mol
Names & identifiers
- Preferred name
- 2-(4-Bromo-3,5-dimethylphenoxy)ethanamine
- IUPAC
- 2-(4-bromo-3,5-dimethylphenoxy)ethanamine
Names & synonyms
2-(4-bromo-3,5-dimethylphenoxy)ethan-1-amine951914-08-22-(4-bromo-3,5-dimethylphenoxy)ethanamineSCHEMBL15262633JQYBSJIYMTZMKC-UHFFFAOYSA-NDB-163154EN300-1913465
Database identifiers
- PubChem CID
- 22688749
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 142
Related reactions
2 records
Compound notes
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