Formula |
C12H14N2O3 |
IUPAC Name |
ethyl 3-(4-carbamimidoylphenyl)-2-oxo-propanoate |
Molecular Mass |
234.251 g·mol−1 |
Heat of Formation |
-351.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.40 ± 1.08 D |
Volume |
286.14 Å 3 |
Surface Area |
272.94 Å 2 |
HOMO Energy |
-9.64 ± 0.55 eV |
LUMO Energy |
-0.32 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-(4-amidinophenyl)-2-keto-propionic acid ethyl ester
- 3-(4-carbamimidoylphenyl)-2-oxopropanoic acid ethyl ester
- 4-amidinophenylpyruvic acid ethyl ester
- 4-appa ethyl ester
- benzenepropanoic acid, 4-(aminoiminomethyl)-alpha-oxo-, ethyl ester
- ethyl 4-amidinophenylpyruvate
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CAS Number(s) |
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InChIKey |
FKDMTKNGKZHNAL-UHFFFAOYSA-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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