Formula |
C11H16N2O5 |
IUPAC Name |
(2s)-3-[4,5-dihydroxy-2-(hydroxymethylamino)phenyl]-2-(methylamino)propanoic acid |
Molecular Mass |
256.255 g·mol−1 |
Heat of Formation |
-872.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.06 ± 1.08 D |
Volume |
298.84 Å 3 |
Surface Area |
270.8 Å 2 |
HOMO Energy |
-8.31 ± 0.55 eV |
LUMO Energy |
-0.04 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- (2s)-3-[4,5-dihydroxy-2-(hydroxymethylamino)phenyl]-2-methylamino-propanoic acid
- (2s)-3-[4,5-dihydroxy-2-(hydroxymethylamino)phenyl]-2-methylaminopropanoic acid
- (2s)-3-[4,5-dihydroxy-2-(methylolamino)phenyl]-2-methylamino-propionic acid
- 3-[4,5-dihydroxy-2-2-(2-hydroxyethylamino)-phenyl]-2-methylamino-propionic acid
- aa6
|
InChIKey |
HMZMIBPZIFJSLM-QMMMGPOBSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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