Basic information
- CAS
152538-36-8- Standard SMILES
COc1cccc([C@@]2(O)CCCC[C@H]2CN(C)C)c1- InChIKey
TVYLLZQTGLZFBW-HOCLYGCPSA-N- Molecular formula
- C16H25NO2
- Average molar mass
- 263.37 g/mol
- Monoisotopic mass
- 263.18852904
Names & identifiers
- Preferred name
- trans-Tramadol
- IUPAC
- trans-(1R,2S)-2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexan-1-ol
- English name
- (1R,2S)-2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexan-1-ol
- Molecular formula
- C16H25NO2
- Molecular weight
- 263.38
Names & synonyms
trans-Tramadol152538-36-8Tramadol, trans-7AO28L53FNDTXSID401317389(1RS,2SR)-2-((Dimethylamino)methyl)-1-(3-methoxyphenyl)cyclohexanolRefChem:1100286DTXCID001747205(+/-)-trans-Tramadol(1R,2S)-2-[(DIMETHYLAMINO)METHYL]-1-(3-METHOXYPHENYL)CYCLOHEXAN-1-OLTramadol, trans-(+)-45PA5S9V4D
Show more names
Tramadol EP Impurity A HClTramadole Related Compound ACyclohexanol, 2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)-, (1R,2S)-rel-trans-TramadolQ: What is trans-Tramadol Q: What is the CAS Number of trans-TramadolTramadol Hydrochloride Impurit Ⅰ:(1R,2S)-rel-2-((Dimethylamino)methyl)-1-(3-methoxyphenyl)cyclohexan-1-ol
Cyclohexanol, 2-((dimethylamino)methyl)-1-(3-methoxyphenyl)-, (1R,2S)-rel-Cyclohexanol, 2-((dimethylamino)methyl)-1-(3-methoxyphenyl)-, (1R,2S)-2148284-56-2Tramadol EP Impurity AUNII-7AO28L53FNUNII-45PA5S9V4DTramadol hydrochloride specified impurity A [EP]SCHEMBL1593740
Database identifiers
- CAS
152538-36-8、2148284-56-2- PubChem CID
- 63015
- DTXSID
DTXSID401317389- UNII
- 45PA5S9V4D、7AO28L53FN
- EC Number
- 604-862-4
- Nikkaji
- J354.350A
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 282
Physicochemical properties
- Boiling point
- 388.1 · 388.1±22.0 °C(Predicted)
- Density
- 1.047 · 1.047±0.06 g/cm3(Predicted)
- pka
- 14.47 · 14.47±0.40(Predicted)
- FDA UNII
- 7 AO28L53FN · 7AO28L53FN
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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