4-Nitrobenzamidoxime - CAS 1613-86-1
Catalog: |
BB011738 |
Product Name: |
4-Nitrobenzamidoxime |
CAS: |
1613-86-1 |
Synonyms: |
N'-hydroxy-4-nitrobenzenecarboximidamide; N'-hydroxy-4-nitrobenzenecarboximidamide |
IUPAC Name: | N'-hydroxy-4-nitrobenzenecarboximidamide |
Description: | 4-Nitrobenzamidoxime (CAS# 1613-86-1) is a useful research chemical. |
Molecular Weight: | 181.15 |
Molecular Formula: | C7H7N3O3 |
Canonical SMILES: | C1=CC(=CC=C1C(=NO)N)[N+](=O)[O-] |
InChI: | InChI=1S/C7H7N3O3/c8-7(9-11)5-1-3-6(4-2-5)10(12)13/h1-4,11H,(H2,8,9) |
InChI Key: | SRNSBDNIAKCXGI-UHFFFAOYSA-N |
Boiling Point: | 410.8 °C at 760 mmHg |
Density: | 1.49 g/cm3 |
MDL: | MFCD00465738 |
LogP: | 1.91280 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020038812-A1 | New process for the preparation of amenamevir | 20180820 |
WO-2018005193-A1 | Compounds and their use for reducing uric acid levels | 20160630 |
US-10752613-B2 | Compounds and their use for reducing uric acid levels | 20160630 |
US-2020339545-A1 | Compounds And Their Use For Reducing Uric Acid Levels | 20160630 |
EP-3432881-A1 | Use of ddx3 inhibitors as antiproliferative agents | 20160324 |
PMID | Publication Date | Title | Journal |
20888086 | 20101201 | Convenient synthesis and biological profile of 5-amino-substituted 1,2,4-oxadiazole derivatives | European journal of medicinal chemistry |
Complexity: | 216 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 181.04874109 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 181.04874109 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 104 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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