Benzeneethanol, b-[(1-methylethyl)amino]-, (bR)-


Chemical Name: Benzeneethanol, b-[(1-methylethyl)amino]-, (bR)-
CAS Number: 112211-92-4
Product Number: AG003C95(AGN-PC-0P35XK)
Synonyms:
MDL No:
Molecular Formula: C11H17NO
Molecular Weight: 179.2588

Identification/Properties


Properties
MP:
169-174°C
BP:
294.8°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
179.263g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
179.131g/mol
Monoisotopic Mass:
179.131g/mol
Topological Polar Surface Area:
32.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
130
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



The chiral compound (R)-2-(Isopropylamino)-2-phenylethanol, also known as $name$, plays a vital role in chemical synthesis as a versatile building block. Its unique structure and chirality make it a valuable intermediate in the preparation of various pharmaceuticals, agrochemicals, and complex organic molecules. One common application of (R)-2-(Isopropylamino)-2-phenylethanol is in the synthesis of beta-blocker drugs, where its chirality is crucial for controlling the stereochemistry and biological activity of the final product. Additionally, this compound can be utilized in the creation of chiral ligands for asymmetric catalysis, enabling the efficient production of enantiomerically pure compounds.Furthermore, (R)-2-(Isopropylamino)-2-phenylethanol can serve as a precursor for the synthesis of chiral auxiliaries and building blocks, facilitating the construction of complex molecular structures with high stereoselectivity. Its presence in the chemical synthesis toolbox highlights its significance in the development of novel compounds with diverse applications in the fields of medicine, agriculture, and material sciences.