Clenbuterol hydrochlorideProduct ingredient for Clenbuterol
- Name
- Clenbuterol hydrochloride
- Drug Entry
- Clenbuterol
A substituted phenylaminoethanol that has beta-2 adrenomimetic properties at very low doses. It is used as a bronchodilator in asthma.
- Accession Number
- DBSALT001621
- Structure
Structure for Clenbuterol hydrochloride (DBSALT001621)
- Synonyms
- Clenbuterol HCl
- UNII
- GOR5747GWU
- CAS Number
- 21898-19-1
- Weight
- Average: 313.65
Monoisotopic: 312.0562963 - Chemical Formula
- C12H19Cl3N2O
- InChI Key
- OPXKTCUYRHXSBK-UHFFFAOYSA-N
- InChI
- InChI=1S/C12H18Cl2N2O.ClH/c1-12(2,3)16-6-10(17)7-4-8(13)11(15)9(14)5-7;/h4-5,10,16-17H,6,15H2,1-3H3;1H
- IUPAC Name
- 1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethan-1-ol hydrochloride
- SMILES
- Cl.CC(C)(C)NCC(O)C1=CC(Cl)=C(N)C(Cl)=C1
- External Links
- ChemSpider
- 28619
- ChEBI
- 31410
- ChEMBL
- CHEMBL1330729
- Wikipedia
- Clenbuterol
- Predicted Properties
Property Value Source Water Solubility 0.112 mg/mL ALOGPS logP 2.94 ALOGPS logP 2.33 Chemaxon logS -3.4 ALOGPS pKa (Strongest Acidic) 14.06 Chemaxon pKa (Strongest Basic) 9.63 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 58.28 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 73.38 m3·mol-1 Chemaxon Polarizability 28.75 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon