≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Protected from light,Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Information
JMJD7-IN-1 is an inhibitor of Jumonji C domain-containing 7 (JMJD7).
| Canonical Smiles | C1=CC2=C(C=CC(=C2N=C1)OC(=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-] |
|---|---|
| IUPAC Name | (5-nitroquinolin-8-yl) 2,4-dichlorobenzoate |
| InChIKey | YKPUGYXWOBGQLL-UHFFFAOYSA-N |
| INCHI | 1S/C16H8Cl2N2O4/c17-9-3-4-10(12(18)8-9)16(21)24-14-6-5-13(20(22)23)11-2-1-7-19-15(11)14/h1-8H |
| Isomeric SMILES | C1=CC2=C(C=CC(=C2N=C1)OC(=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-] |
| Molecular Weight | 363.1 |
| Reaxy-Rn | 37667727 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=37667727&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Quinolines and derivatives |
| Subclass | Nitroquinolines and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Nitroquinolines and derivatives |
| Alternative Parents | 2-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Benzoic acid esters Benzoyl derivatives Dichlorobenzenes Nitroaromatic compounds Pyridines and derivatives Aryl chlorides Vinylogous halides Heteroaromatic compounds Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organochlorides Organonitrogen compounds Organooxygen compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Nitroquinoline - Benzoate ester - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Benzoic acid or derivatives - Nitroaromatic compound - Benzoyl - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Vinylogous halide - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Azacycle - Organooxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as nitroquinolines and derivatives. These are compounds containing a nitro group attached to a quinoline moiety. |
| External Descriptors | Not available |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 C2429805 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429806 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429807 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429808 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429809 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429810 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429811 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429812 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429813 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429814 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429833 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429834 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429835 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| C2429836 | Certificate of Analysis | Feb 04, 2024 | J413694 |
| Sensitivity | light sensitive |
|---|---|
| Molecular Weight | 363.100 g/mol |
| XLogP3 | 4.700 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 361.986 Da |
| Monoisotopic Mass | 361.986 Da |
| Topological Polar Surface Area | 85.000 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 487.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
