IUPAC Name: | 2-methoxy-5-nitroaniline |
Description: | 2-Methoxy-5-nitroaniline (CAS# 99-59-2) is a guanylate cyclase-C agonist currently being studied in Phase 3 trials for the treatment of irritable bowel syndrome with constipation. |
Molecular Weight: | 168.15 |
Molecular Formula: | C7H8N2O3 |
Canonical SMILES: | COC1=C(C=C(C=C1)[N+](=O)[O-])N |
InChI: | InChI=1S/C7H8N2O3/c1-12-7-3-2-5(9(10)11)4-6(7)8/h2-4H,8H2,1H3 |
InChI Key: | NIPDVSLAMPAWTP-UHFFFAOYSA-N |
Boiling Point: | 351.8 °C at 760 mmHg |
Melting Point: | 116-120 °C |
Purity: | 97 % |
Density: | 1.2068 g/cm3 |
Appearance: | Orange-red needles or orange powder. |
Storage: | Store in a cool, dry, well-ventilated area away from incompatible substances. Keep containers tightly closed. |
Decomposition: | When heated to decomposition it emits toxic fumes of /nitrogen oxides |
MDL: | MFCD00007261 |
LogP: | 2.29000 |
Vapor Pressure: | 0.000319 [mmHg] |
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Related Functional Groups
Nitrogen Compounds
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
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