Basic information
- CAS
53566-99-7- Standard SMILES
Cc1cc(O)cc(C)c1OCC(C)N- InChIKey
YWOSWRCXWBDSRQ-UHFFFAOYSA-N- Molecular formula
- C11H17NO2
- Average molar mass
- 195.26 g/mol
- Monoisotopic mass
- 195.12592879
Overview
P-hydroxymexiletine is a member of phenols and an aromatic ether.
Names & identifiers
- Preferred name
- 4-(2-Aminopropoxy)-3,5-dimethylphenol
- IUPAC
- 4-(2-aminopropoxy)-3,5-dimethylphenol
- English name
- Phenol, 4-(2-aminopropoxy)-3,5-dimethyl-
- Molecular formula
- C11H17NO2
- Molecular weight
- 195.26
Names & synonyms
p-Hydroxymexiletine53566-99-7Phenol, 4-(2-aminopropoxy)-3,5-dimethyl-4-(2-Aminopropoxy)-3,5-dimethylphenol4-Hydroxymexiletinepara-HydroxymexiletineD9M8AQ3NDJDTXSID60968334RefChem:912068DTXCID00908471UNII-D9M8AQ3NDJCHEMBL6188657
Show more names
p-Hydroxy mexiletine1-(2,6-Dimethyl-4-hydroxyphenoxy)propan-2-amine
SCHEMBL30633090CHEBI:173536YWOSWRCXWBDSRQ-UHFFFAOYSA-NKO 21274-(2-Aminopropoxy)-3,5-dimethylphenol #DB-327182
Database identifiers
- CAS
53566-99-7- PubChem CID
- 93286
- DTXSID
DTXSID60968334- ChEMBL
CHEMBL6188657- ChEBI
CHEBI:173536- UNII
- D9M8AQ3NDJ
- Nikkaji
- J391.089J
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 55.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Boiling point
- 340.6 · 340.6±42.0 °C(Predicted)
- Density
- 1.075 · 1.075±0.06 g/cm3(Predicted)
- pka
- 10.55 · 10.55±0.25(Predicted)
- FDA UNII
- 9 M8AQ3NDJ · D9M8AQ3NDJ
Chemistry & industry
Pharmacology
Tissue LocationsKidney
Cellular LocationsCytoplasm
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Additional notes
DefinitionChEBI: P-hydroxymexiletine is a member of phenols and an aromatic ether.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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