3-tert-Butyl-L-Serine

Name: 3-tert-Butyl-L-Serine
Brand: BOC Sciences
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Molecular Formula:

C7H15NO3

Molecular Weight:

161.2

CAS Number:

171866-72-1

Catalog Number:

171866-72-1

Product Information

Molecular Formula:

C7H15NO3

Molecular Weight:

161.2

Description

Applications: (2S,3R)-2-Amino-3-hydroxy-4,4-dimethylpentanoic Acid has been used in DNA-templated library synthesis of small molecules as a capping molecule. This method allows for a higher diversity in size and structure of the macrocycle library.

Synonyms

3-tert-Butyl-L-serine; (2R,3S)-2-Amino-3-hydroxy-4,4-dimethylpentanoic acid; L-Leucine, 3-hydroxy-4-methyl-, threo-; D-β-t-butylserine

IUPAC Name

(2S,3R)-2-amino-3-hydroxy-4,4-dimethylpentanoic acid

Canonical SMILES

CC(C)(C)C(C(C(=O)O)N)O

InChI

InChI=1S/C7H15NO3/c1-7(2,3)5(9)4(8)6(10)11/h4-5,9H,8H2,1-3H3,(H,10,11)/t4-,5-/m0/s1

InChI Key

DREONSBNBZFXLW-WHFBIAKZSA-N

Boiling Point

320.3°C at 760 mmHg

Melting Point

320.3°C at 760 mmHg

Flash Point

147.5°C

Purity

98%

Density

1.145 g/cm3

Computed Properties

XLogP3

-1.6

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

161.10519334 g/mol

Monoisotopic Mass

161.10519334 g/mol

Topological Polar Surface Area

83.6Å²

Heavy Atom Count

Formal Charge

Complexity

150

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

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Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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3-tert-Butyl-L-Serine

Product Information

Computed Properties

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