Basic information
- CAS
10329-60-9- Standard SMILES
CNC(C)C(O)c1ccc(O)c(O)c1- InChIKey
DDBFLXGTCAVAFD-UHFFFAOYSA-N- Molecular formula
- C10H15NO3
- Average molar mass
- 197.23 g/mol
- Monoisotopic mass
- 197.10519334
Overview
Dioxifedrine is a beta-2 -adrenergic agonist with bronchodilator activity. Dioxifedrine selectively binds to and activates beta-2 adrenergic receptors in bronchiolar smooth muscle, thereby causing stimulation of adenyl cyclase, the enzyme that catalyzes the conversion of adenosine triphosphate (ATP) to cyclic-3',5'-adenosine monophosphate (cAMP). Increased intracellular cAMP levels cause relaxation of bronchial smooth muscle. This increases air flow and prevents bronchospasms and may eventually lead to an improvement of airway function.
Names & identifiers
- Preferred name
- Dioxifedrine
- IUPAC
- 4-[1-hydroxy-2-(methylamino)propyl]benzene-1,2-diol
- English name
- dioxifedrine
- Molecular formula
- C10H15NO3
- Molecular weight
- 197.23
Names & synonyms
Dioxifedrine10329-60-9DioxifedrinaDioxifedrinumDioxyphedrineDioxifedrinDioxifedrine [INN]Dioxifedrinum [INN-Latin]Dioxifedrina [INN-Spanish]UNII-CF48QOH154CF48QOH154EINECS 233-716-9
Show more names
alpha-methylepinephrine1,2-Benzenediol, 4-[1-hydroxy-2-(methylamino)propyl]-3,4-Dihydroxy-α-[1-(methylamino)ethyl]benzenemethanol
DTXSID40864249Dioxifedrinum (INN-Latin)Dioxifedrina (INN-Spanish)3,4-Dihydroxy-alpha-(1-(methylamino)ethyl)benzyl alcohol3,4-DIHYDROXY-.ALPHA.-(1-(METHYLAMINO)ETHYL)BENZYL ALCOHOLdioxyphAdrineRefChem:134581DTXCID20812788
Database identifiers
- CAS
10329-60-9- PubChem CID
- 13683
- DTXSID
DTXSID40864249- ChEMBL
CHEMBL416557- UNII
- CF48QOH154
- EC Number
- 233-716-9
- Nikkaji
- J10.478G
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 72.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 177
Physicochemical properties
- Boiling point
- 165 · 165-170 °C(Press: 2 Torr)
- Density
- 1.236 · 1.236±0.06 g/cm3(Predicted)
- pka
- 9.59 · 9.59±0.10(Predicted)
- FDA UNII
- 48 QOH154 · CF48QOH154
Chemistry & industry
Suppliers2 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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