| Weight | 195.174 g/mol |
|---|---|
| Formula | C9H9NO4 |
| Hydrogen Acceptors | 4 |
| Hydrogen Donors | 0 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 2 |
Methyl 4-methyl-3-nitrobenzoate (7356-11-8)
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- Discovery of 4-oxo-6-((pyrimidin-2-ylthio)methyl)-4H-pyran-3-yl 4-nitrobenzoate (ML221) as a functional antagonist of the apelin (APJ) receptor (Bioorganic & Medicinal Chemistry Letters, 2012)
- Photolytic rearrangement of metronidazole to N-(2-hydroxyethyl)-5-methyl-1,2,4-oxadiazole-3-carboxamide. Crystal structure of its 4-nitrobenzoate derivative (Journal of The Chemical Society-perkin Transactions 1, 1987)
- The crystal and molecular structure of 3-(1,4-epoxy-2-hydroxy-2,6,6-trimethylcyclohexyl)-1-methyl-2-propyl p-nitrobenzoate. (Bulletin of the Chemical Society of Japan, 1982)
- Hydrogen-bonded chains of rings in methyl 4-[(5-methyl-1H-pyrazol-3-yl)amino]-3-nitrobenzoate and hydrogen-bonded sheets in methyl 1-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole-5-carboxylate. (Acta Crystallographica Section C-crystal Structure Communications, 2007)
- ChemInform Abstract: Discovery of 4Oxo6((pyrimidin2ylthio)methyl)4Hpyran3yl 4Nitrobenzoate (I) (ML221) as a Functional Antagonist of the Apelin (APJ) Receptor. (ChemInform, 2013)
- 13-Methyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl 4-nitrobenzoate (Acta Crystallographica Section E: Crystallographic Communications, 2007)
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. -
SMILESCC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]
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InChIKeyYFPBHPCMYFCRKS-UHFFFAOYSA-N
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