(S)-2-(2-Bromophenyl)-2-((tert-butoxycarbonyl)amino)acetic acid|1228547-87-2,AngeneChemical

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Pyrimidine, 5-bromo-2-methyl-

1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide

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)-

(S)-2-(2-Bromophenyl)-2-((tert-butoxycarbonyl)amino)acetic acid

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Chemical Name:	(S)-2-(2-Bromophenyl)-2-((tert-butoxycarbonyl)amino)acetic acid
CAS Number:	1228547-87-2
Product Number:	AG000JLB(AGN-PC-0WAMA0)
Synonyms:
MDL No:	MFCD07371725
Molecular Formula:	C13H16BrNO4
Molecular Weight:	330.1744

Identification/Properties
Safety Information
NMR Spectrum
Other Analytical Data
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Identification/Properties

Computed Properties

Molecular Weight:

330.178g/mol

XLogP3:

2.9

Hydrogen Bond Donor Count:

Hydrogen Bond Acceptor Count:

Rotatable Bond Count:

Exact Mass:

329.026g/mol

Monoisotopic Mass:

329.026g/mol

Topological Polar Surface Area:

75.6A^2

Heavy Atom Count:

Formal Charge:

Complexity:

340

Isotope Atom Count:

Defined Atom Stereocenter Count:

Undefined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Undefined Bond Stereocenter Count:

Covalently-Bonded Unit Count:

Compound Is Canonicalized:

Yes

Safety Information

GHS Pictogram:

Signal Word:

Warning

UN#:

Hazard Statements:

H302

Precautionary Statements:

P280-P305+P351+P338

Class:

Packing Group:

NMR Spectrum

Other Analytical Data

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Chemical Structure

The (S)-2-(2-Bromophenyl)-2-((tert-butoxycarbonyl)amino)acetic acid, or $name$, is a valuable compound widely used in chemical synthesis as a chiral building block. Its unique structure allows for precise control over stereochemistry in reactions, making it a key component in the production of pharmaceuticals, agrochemicals, and advanced materials. When incorporated into synthetic pathways, this compound enables the selective formation of chiral molecules with enhanced biological activity and improved properties. By serving as a versatile starting material, (S)-2-(2-Bromophenyl)-2-((tert-butoxycarbonyl)amino)acetic acid plays a crucial role in the development of new chemical entities and the advancement of modern synthetic methodologies.