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L(+)-allo-Threonine

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L(+)-allo-Threonine Basic information

Product Name:
L(+)-allo-Threonine
Synonyms:
  • l-allothreonin
  • O-T-BUTYL-L-ALLO-THREONINE
  • H-ALLO-THR(BUT)-OH
  • H-ALLO-THR-O
  • H-ALLO-THR-OH
  • H-ALLO-THR(TBU)-OH
  • H-L-ALLO-THR-OH
  • L(+)-ALLO-THREONINE
CAS:
28954-12-3
MF:
C4H9NO3
MW:
119.12
EINECS:
249-327-2
Product Categories:
  • amino acid derivative
  • Threonine [Thr, T]
  • Amino Acids
Mol File:
28954-12-3.mol
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L(+)-allo-Threonine Chemical Properties

Melting point:
272 °C (dec.)(lit.)
alpha 
9 º (c=2, H2O)
Boiling point:
222.38°C (rough estimate)
Density 
1.3126 (rough estimate)
refractive index 
10 ° (C=5, H2O)
storage temp. 
Keep in dark place,Sealed in dry,Room Temperature
solubility 
Water (Slightly)
pka
pK1: 2.108(+1);pK2: 9.096(0) (25°C)
form 
Crystalline Powder
color 
White to off-white
optical activity
[α]23/D +9.0°, c = 2 in H2O
BRN 
1721645
InChI
InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m0/s1
InChIKey
AYFVYJQAPQTCCC-HRFVKAFMSA-N
SMILES
C(O)(=O)[C@H]([C@@H](O)C)N
CAS DataBase Reference
28954-12-3(CAS DataBase Reference)
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Safety Information

Safety Statements 
24/25
WGK Germany 
3
RTECS 
BA4055000
HS Code 
29225090

MSDS

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L(+)-allo-Threonine Usage And Synthesis

Chemical Properties

white to off-white crystalline powder

Uses

L-allo-Threonine is a reactant used in the synthesis of an antibiotic, globomycin, and its congener, SF-1902 A5.

Definition

ChEBI: L-allothreonine is the L-enantiomer of allothreonine. It has a role as an Escherichia coli metabolite and a Saccharomyces cerevisiae metabolite. It is an allothreonine and a L-alpha-amino acid. It is an enantiomer of a D-allothreonine. It is a tautomer of a L-allothreonine zwitterion.

reaction suitability

reaction type: solution phase peptide synthesis

Synthesis

64420-00-4

72-19-5

The general procedure for the synthesis of L-threonine from 5-(1-hydroxyethyl)urea (CAS:64420-00-4) is as follows: in a 1 L autoclave, 144 g (1 mol) of 5-(1-hydroxyethyl)urea, 68 g of 25% ammonia, 110 g of calcium hydroxide (1.5 mol), 500 g of water, and 50 mL of n-butanol were added in sequence. The mixture was heated to 160-170°C and the reaction pressure was maintained at 1.5-2.0 MPa for 4 hours. Upon completion of the reaction, the mixture was cooled to room temperature and the pH was adjusted by passing carbon dioxide to 8. The reaction mixture was filtered and the mother liquor was concentrated under reduced pressure. To the residue, 150 g of methanol was added and refluxed for 2 h. Crystals were precipitated after cooling. The crystals were collected by filtration, and the filter cake was dried under vacuum at 120°C for 4 h. 106.4 g of 2-amino-3-hydroxybutyric acid was obtained with a purity of 96% and a yield of 89.4%.

References

[1] Patent: CN104892521, 2018, B. Location in patent: Paragraph 0069; 0070

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