alpha-(4-Bromophenyl)-alpha-[2-(dimethyl-d6-amino)ethyl]-3-pyridinemethanol
Basic information
- CAS
1189936-97-7- Standard SMILES
[2H]C([2H])([2H])N(CCC(O)(c1ccc(Br)cc1)c1cccnc1)C([2H])([2H])[2H]- InChIKey
YAYXSVOPNBARLP-WFGJKAKNSA-N- Molecular formula
- C16H19BrN2O
- Average molar mass
- 341.27 g/mol
- Monoisotopic mass
- 340.10574
Names & identifiers
- Preferred name
- alpha-(4-Bromophenyl)-alpha-[2-(dimethyl-d6-amino)ethyl]-3-pyridinemethanol
- IUPAC
- 3-[bis(trideuteriomethyl)amino]-1-(4-bromophenyl)-1-pyridin-3-ylpropan-1-ol
- English name
- α-(4-Bromophenyl)-α-[2-(dimethyl-d6-amino)ethyl]-3-pyridinemethanol
- Molecular formula
- C16H19BrN2O
- Molecular weight
- 335.23886
Names & synonyms
1189936-97-7alpha-(4-Bromophenyl)-alpha-[2-(dimethyl-d6-amino)ethyl]-3-pyridinemethanol3-[bis(trideuteriomethyl)amino]-1-(4-bromophenyl)-1-pyridin-3-ylpropan-1-olDTXSID806757303-{Bis[(~2~H_3_)methyl]amino}-1-(4-bromophenyl)-1-(pyridin-3-yl)propan-1-olα-(4-Bromophenyl)-α-[2-(dimethyl-d6-amino)ethyl]-3-pyridinemethanol
Database identifiers
- CAS
1189936-97-7- PubChem CID
- 46780901
- DTXSID
DTXSID80675730
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 36.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 292
Physicochemical properties
- solubility
- Chloroform, Methanol
- form
- Solid
- color
- Brown
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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