ChemicalBook > CAS DataBase List > (S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID

(S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID

Product Name
(S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID
CAS No.
190897-47-3
Chemical Name
(S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID
Synonyms
(s)-boc-β2-homoala-oh;Boc-S-3-Aminoisobutyric acid;(S)-Boc-β2-HomoAla-OH≥ 99% (TLC);Boc-(S)-3-AMino-2-Methylpropanoic acid;(S)-N-Boc-3-amino-2-methylpropionic Acid;(2S)-3-(Boc-amino)-2-methyl-propanoic acid;(S)-3-(Boc-amino)-2-methylpropionic acid;(S)-3-(tert-ButoxycarbonylaMino)-2-Methylpropanoic acid;(Tert-Butoxy)Carbonyl (S)-3-Amino-2-methylpropanoic acid;Boc-S-3-AMinoisobutyric acid Boc-S-3-AMinoisobutyric acid
CBNumber
CB7502619
Molecular Formula
C9H17NO4
Formula Weight
203.24
MOL File
190897-47-3.mol
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(S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID Property

Melting point:
88 °C(lit.)
Boiling point:
339.5±25.0 °C(Predicted)
Density 
1.101±0.06 g/cm3(Predicted)
storage temp. 
Sealed in dry,2-8°C
pka
4.53±0.10(Predicted)
Appearance
White to off-white Solid
optical activity
[α]20/D +12±2°, c = 1% in DMF
BRN 
8037279
InChI
InChI=1S/C9H17NO4/c1-6(7(11)12)5-10-8(13)14-9(2,3)4/h6H,5H2,1-4H3,(H,10,13)(H,11,12)/t6-/m0/s1
InChIKey
GDQRNRYMFXDGMS-LURJTMIESA-N
SMILES
C(O)(=O)[C@@H](C)CNC(OC(C)(C)C)=O
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Safety

WGK Germany 
3
3-10
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

TRC
Product number
B630305
Product name
(S)-3-(Boc-amino)-2-methylpropionic acid
Packaging
50mg
Price
$130
Updated
2021/12/16
Chem-Impex
Product number
14283
Product name
(S)-Boc-β2-HomoAla-OH,99%(TLC)
Purity
99%(TLC)
Packaging
100MG
Price
$140
Updated
2021/12/16
Biosynth Carbosynth
Product number
FB49836
Product name
(S)-3-(Boc-amino)-2-methylpropionic acid
Packaging
50mg
Price
$160
Updated
2021/12/16
Biosynth Carbosynth
Product number
FB49836
Product name
(S)-3-(Boc-amino)-2-methylpropionic acid
Packaging
10mg
Price
$65
Updated
2021/12/16
Biosynth Carbosynth
Product number
FB49836
Product name
(S)-3-(Boc-amino)-2-methylpropionic acid
Packaging
25mg
Price
$100
Updated
2021/12/16
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(S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID Chemical Properties,Usage,Production

Chemical Properties

White powder

Synthesis

168828-18-0

190897-47-3

The general procedure for the synthesis of (S)-3-((tert-butoxycarbonyl)amino)-2-methylpropanoic acid using tert-butyl (S)-2-(methoxycarbonyl)propylcarbamate as a raw material was as follows: firstly, 1.30 g (5.98 mmol) of (2S)-3-[(tert-butoxycarbonyl)amino]-2-methylpropanoic acid methyl ester was dissolved in 16 mL of tetrahydrofuran and 4 mL of distilled water in a mixed in the solvent. Subsequently, 0.75 g (18.0 mmol) of lithium hydroxide was added and the reaction was stirred at room temperature for 15 hours. Upon completion of the reaction, the solvent was removed by distillation under reduced pressure, ethyl acetate was added, the reaction solution was neutralized with 1N HCl, and the organic phase was dried with magnesium sulfate. After that, the solvent was removed by distillation and the residue was purified by column chromatography to give 1.05 g of the target compound in 87% yield. Next, the resulting compound was dissolved in 20 mL of diethyl ether and cooled to -30°C. At this temperature, 0.82 mL (5.90 mmol) of triethylamine and 0.78 mL (5.90 mmol) of isobutyl chloroformate were added sequentially. After stirring for 15 minutes, diazomethane dissolved in diethyl ether was slowly added (in excess). After continued stirring for 2 hours, acetic acid and ethyl acetate were added sequentially and the reaction solution was washed with sodium carbonate solution and water. The organic phase was dried and the residue was purified by column chromatography to give 0.31 g of (S)-3-((tert-butoxycarbonyl)amino)-2-methylpropanoic acid in 28% yield. The product was confirmed by 1H NMR (CDCl3): δ 5.35 (1H, s), 5.01 (1H, s), 3.28 (2H, t, J=6Hz), 2.71 (1H, m), 1.45 (9H, s), 1.15 (3H, d, J=6.8Hz). Mass spectral analysis showed m/e of 228 (M+1).

References

[1] Patent: WO2008/93960, 2008, A1. Location in patent: Page/Page column 25-26

(S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID Preparation Products And Raw materials

Raw materials

Preparation Products

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(S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID Suppliers

Accela ChemBio Inc.
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View Lastest Price from (S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID manufacturers

Career Henan Chemical Co
Product
(S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID 190897-47-3
Price
US $6.60/KG
Min. Order
1KG
Purity
97%-99%
Supply Ability
1kg-1000kg
Release date
2019-12-25
Career Henan Chemical Co
Product
Hydrocortisone sodium phosphate 190897-47-3
Price
US $6.60/KG
Min. Order
1KG
Purity
97%-99%
Supply Ability
1kg-1000kg
Release date
2019-12-25

190897-47-3, (S)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACIDRelated Search:


  • Boc-S-3-Aminoisobutyric acid
  • Propanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, (2S)- (9CI)
  • (s)-boc-β2-homoala-oh
  • 2S-METHYL-3-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-PROPANOIC ACID
  • (S)-3-(tert-ButoxycarbonylaMino)-2-Methylpropanoic acid
  • Boc-S-3-AMinoisobutyric acid Boc-S-3-AMinoisobutyric acid
  • Boc-(S)-3-AMino-2-Methylpropanoic acid
  • (<I>S</I>)<WBR>-<WBR>3-<WBR>(Boc-<WBR>aMino)<WBR>-<WBR>2-<WBR>Methylpropionic acid
  • (<I>S</I>)-3-(Boc-amino)-2-methylpropionic acid
  • (S)-Boc-β2-HomoAla-OH≥ 99% (TLC)
  • (Tert-Butoxy)Carbonyl (S)-3-Amino-2-methylpropanoic acid
  • (2S)-3-{[(tert-butoxy)carbonyl]amino}-2-methylpropanoic acid
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  • (S)-3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid - [B91859]
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