Metaterol Hydrochloride - CAS 55688-38-5
Catalog: |
BB060306 |
Product Name: |
Metaterol Hydrochloride |
CAS: |
55688-38-5 |
Synonyms: |
3-Hydroxy-α-[[(1-methylethyl)amino]methyl]benzenemethanol Hydrochloride; m-Hydroxy-α-(isopropylaminomethyl)benzyl Alcohol Hydrochloride; 1-(3-Hydroxyphenyl)-2-(isopropylamino)ethanol Hydrochloride; NSC 141967; dl-1-(3-Hydroxyphenyl)-2-isopropylaminoethanol Hydrochloride; α-[(Isopropylamino)methyl]-m-hydroxybenzyl Alcohol Hydrochloride |
IUPAC Name: | 3-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenolhydrochloride |
Description: | Metaterol hydrochloride is the hydrochloride salt of Metaterol, a sympathomimetic drug that causes vasoconstriction and mydriasis when used on the eye. |
Molecular Weight: | 231.72 |
Molecular Formula: | C11H18ClNO2 |
Canonical SMILES: | CC(C)NCC(C1=CC(=CC=C1)O)O.Cl |
InChI: | InChI=1S/C11H17NO2.ClH/c1-8(2)12-7-11(14)9-4-3-5-10(13)6-9/h3-6,8,11-14H,7H2,1-2H31H |
InChI Key: | QWELSVCCXLINHO-UHFFFAOYSA-N |
Melting Point: | >128°C (dec.) |
Solubility: | DMSO (Slightly, Heated), Methanol (Slightly) |
Appearance: | Light Brown Solid |
Storage: | Hygroscopic, -20°C Freezer, Under inert atmosphere |
References: | Weekers, R. & Collignon-Brach, J. Acta Ophthalmol., 44, 762 (1966). |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 231.1026065 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 231.1026065 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 52.5Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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