Basic information
- CAS
157729-12-9- Standard SMILES
CC(C)NCc1cccc(Br)c1O- InChIKey
MHLALCUURNGDFQ-UHFFFAOYSA-N- Molecular formula
- C10H14BrNO
- Average molar mass
- 244.13 g/mol
- Monoisotopic mass
- 243.02588
Names & identifiers
- Preferred name
- 2-Bromo-6-{[(propan-2-yl)amino]methyl}phenol
- IUPAC
- 2-bromo-6-[(propan-2-ylamino)methyl]phenol
Names & synonyms
2-bromo-6-{[(propan-2-yl)amino]methyl}phenol157729-12-9DTXSID501246345AKOS010648736EN300-1678352-Bromo-6-[[(1-methylethyl)amino]methyl]phenol
Database identifiers
- CAS
157729-12-9- PubChem CID
- 61389573
- DTXSID
DTXSID501246345
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 152
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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