Formula |
C16H16N4O3 |
IUPAC Name |
(4-acetamidophenyl) 4-guanidinobenzoate |
Molecular Mass |
312.323 g·mol−1 |
Heat of Formation |
-276.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.07 ± 1.08 D |
Volume |
360.12 Å 3 |
Surface Area |
341.59 Å 2 |
HOMO Energy |
-8.58 ± 0.55 eV |
LUMO Energy |
-0.63 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4'-aagb
- 4'-acetamidophenyl 4-guanidinobenzoate
- 4'-acetoamidophenyl 4-guadinobenzoate
- 4-guanidinobenzoic acid (4-acetamidophenyl) ester
- 79119-49-6 (hydrochloride)
- benzoic acid, 4-((aminoiminomethyl)amino)-, 4-(acetylamino)phenyl ester
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InChIKey |
VACGBZYEDFQOIU-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
O
N
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