Formula |
C13H17NO4 |
IUPAC Name |
ethyl (2s)-2-acetamido-3-(4-hydroxyphenyl)propanoate |
Molecular Mass |
251.278 g·mol−1 |
Heat of Formation |
-726.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.41 ± 1.08 D |
Volume |
311.83 Å 3 |
Surface Area |
267.84 Å 2 |
HOMO Energy |
-9.15 ± 0.55 eV |
LUMO Energy |
-0.08 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (2s)-2-acetamido-3-(4-hydroxyphenyl)propanoic acid ethyl ester
- (2s)-2-acetamido-3-(4-hydroxyphenyl)propionic acid ethyl ester
- ac-tyr-oet
- atee
- ethyl (2s)-2-acetamido-3-(4-hydroxyphenyl)propanoate
- ethyl n-alpha-acetyl-tyrosinate
- n-acetyl-l-tyrosine ethyl ester
- n-acetyl-l-tyrosine ethyl ester monohydrate
- tyrosine, n-acetyl-, ethyl ester, l- (8ci)
|
CAS Number(s) |
- 36546-50-6
- 840-97-1
- 7584-82-9
|
InChIKey |
SKAWDTAMLOJQNK-LBPRGKRZSA-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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