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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Benzenemethanol, 2-bromo-a-methyl-, (aS)-

C[C@@H](c1ccccc1Br)O Request for Quotation
Chemical Name: Benzenemethanol, 2-bromo-a-methyl-, (aS)-
CAS Number: 114446-55-8
Product Number: AG000EEQ(AGN-PC-0P69GX)
Synonyms:
MDL No:
Molecular Formula: C8H9BrO
Molecular Weight: 201.0605

Identification/Properties

Properties
MP:
56-58 °C
BP:
128°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5610 (estimate)
Computed Properties
Molecular Weight:
201.06g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
199.98368g/mol
Monoisotopic Mass:
199.98368g/mol
Topological Polar Surface Area:
20.2Ų
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
105
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

PNMR/S---2-BROMO-ALPHA-METHYLBENZYL_ALCOHOL-114446-55-8-hnmr.pdf

Other Analytical Data

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Chemical Structure


(S)-1-(2-Bromophenyl)ethanol, also known as (S)-2-Bromo-1-phenylethanol, is a key building block in organic chemistry that finds wide application in chemical synthesis. Its chiral nature makes it particularly valuable in the preparation of pharmaceuticals, agricultural chemicals, and other fine chemicals where the stereochemistry of the molecule plays a crucial role in determining its biological activity or physical properties.One of the notable applications of (S)-1-(2-Bromophenyl)ethanol is its use as a chiral auxiliary in asymmetric synthesis. By taking advantage of the stereochemistry of this compound, chemists can control the stereochemical outcome of various reactions, leading to the selective formation of enantiomerically pure products. This is particularly important in the pharmaceutical industry, where the efficacy and safety of drugs often depend on the specific stereochemistry of the active ingredient.In addition, (S)-1-(2-Bromophenyl)ethanol can be utilized in the synthesis of chiral ligands for catalysis, allowing for the development of more efficient and selective chemical transformations. Its versatile reactivity also enables its incorporation into complex molecules, making it a valuable tool for constructing structurally intricate organic compounds.Overall, the unique stereochemistry and reactivity of (S)-1-(2-Bromophenyl)ethanol make it a valuable building block in chemical synthesis, with diverse applications in the creation of chiral compounds with specific biological or industrial properties.