A9377
DL-Ala-DL-Ala
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About This Item
Empirical Formula (Hill Notation):
C6H12N2O3
CAS Number:
Molecular Weight:
160.17
EC Number:
MDL number:
UNSPSC Code:
12352200
PubChem Substance ID:
Assay
≥98% (TLC)
form
powder
color
white
mp
268-270 °C
storage temp.
−20°C
SMILES string
CC(N)C(=O)NC(C)C(O)=O
InChI
1S/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)
InChI key
DEFJQIDDEAULHB-UHFFFAOYSA-N
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Storage Class Code
13 - Non Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
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Shahab A Shamsi
Electrophoresis, 23(22-23), 4036-4051 (2002-12-14)
A review is presented to highlight several approaches for coupling capillary electrophoresis (CE) and electrospray ionization-mass spectrometry (ESI-MS) for analysis of chiral compounds. A short discussion of commercially available CE-MS instruments and interface design is followed by a detail review
Ana Maria Castilla et al.
Beilstein journal of organic chemistry, 6, 5-5 (2010-05-21)
We present here the design, synthesis, and analysis of a series of receptors for peptide ligands inspired by the hydrogen-bonding pattern of protein β-sheets. The receptors themselves can be regarded as strands 1 and 3 of a three-stranded β-sheet, with
Shifei Xia et al.
Electrophoresis, 30(16), 2837-2844 (2009-08-06)
Enantiomer of chiral dipeptides were separated by CE-ESI-MS in a bare fused-silica capillary using (+)-(18-crown-6)-2,3,11,12-tetracarboxylic acid (18C6H4) as the chiral selector. As 18C6H4 is a kind of nonvolatile chiral selector, in order to prevent from 18C6H4 into the ion-source of
Yannick G Spill et al.
Journal of computational chemistry, 34(2), 132-140 (2012-09-11)
Replica-exchange is a powerful simulation method for sampling the basins of a rugged energy landscape. The replica-exchange method's sampling is efficient because it allows replicas to perform round trips in temperature space, thereby visiting both low and high temperatures in
Andrew L Ferguson et al.
The Journal of chemical physics, 134(13), 135103-135103 (2011-04-12)
Nonlinear dimensionality reduction techniques can be applied to molecular simulation trajectories to systematically extract a small number of variables with which to parametrize the important dynamical motions of the system. For molecular systems exhibiting free energy barriers exceeding a few
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