3-Formyl-6-nitrochromone - CAS 42059-80-3
Catalog: |
BB025028 |
Product Name: |
3-Formyl-6-nitrochromone |
CAS: |
42059-80-3 |
Synonyms: |
6-nitro-4-oxochromene-3-carbaldehyde |
IUPAC Name: | 6-nitro-4-oxochromene-3-carbaldehyde |
Description: | 3-Formyl-6-nitrochromone (CAS# 42059-80-3) is a useful research chemical. |
Molecular Weight: | 219.15 |
Molecular Formula: | C10H5NO5 |
Canonical SMILES: | C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=CO2)C=O |
InChI: | InChI=1S/C10H5NO5/c12-4-6-5-16-9-2-1-7(11(14)15)3-8(9)10(6)13/h1-5H |
InChI Key: | JBDRQGWTNRIJRV-UHFFFAOYSA-N |
MDL: | MFCD00192184 |
LogP: | 2.03690 |
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 |
CN-113214136-A | Compound containing spiro cyclopentadiene-2-oxindole and preparation method and application thereof | 20210518 |
CN-106397381-B | 2- alkoxy chromone 9 oxime derivate and the preparation method and application thereof | 20160909 |
KR-101795283-B1 | Novel synthetic method of 2-pyridone compounds | 20160630 |
EP-2558577-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
US-2013281324-A1 | Bi-functinal complexes and methods for making and using such complexes | 20100416 |
PMID | Publication Date | Title | Journal |
18019419 | 20070901 | Biological activity of 3-formylchromones and related compounds | In vivo (Athens, Greece) |
12852966 | 20030804 | Formylchromone derivatives as a novel class of protein tyrosine phosphatase 1B inhibitors | Bioorganic & medicinal chemistry letters |
Complexity: | 370 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.01677226 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.01677226 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 89.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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