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9-Oxo-10(9H)-acridineacetic acid - for HPLC derivatization, ≥99.0% (T), high purity , CAS No.38609-97-1
Basic Description
Synonyms
10-Carboxymethyl-10H-acridine-9-one sodium salt | CRIDANIMOD [WHO-DD] | 10-carboxymethyl-9-acridanone;10-CMA;XBIO-101;9-Oxo-10(9H)-acridineacetic acid | CBDivE_005011 | 10-(Carboxymethyl)-9(10H)acridone | 10-(Carboxymethyl)-9(10H)-acridone | 2-(9-oxo-10-a
Specifications & Purity
for HPLC derivatization, ≥99%(T)
Shipped In
Normal
Grade
for HPLC derivatization
Product Description
9-Oxo-10(9H)-acridineacetic acid and its analogs,as interferon inducers,are used for studying their potential activity.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Benzoquinolines
Intermediate Tree Nodes
Acridines
Direct Parent
Acridones
Alternative Parents
Hydroquinolones Hydroquinolines Alpha amino acids and derivatives Pyridines and derivatives Benzenoids Vinylogous amides Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acridone - Dihydroquinolone - Alpha-amino acid or derivatives - Dihydroquinoline - Pyridine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as acridones. These are acridines containing a ketone group attached to the C9 carbon atom of the acridine moiety.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
2-(9-oxoacridin-10-yl)acetic acid
INCHI
InChI=1S/C15H11NO3/c17-14(18)9-16-12-7-3-1-5-10(12)15(19)11-6-2-4-8-13(11)16/h1-8H,9H2,(H,17,18)
InChIKey
UOMKBIIXHQIERR-UHFFFAOYSA-N
Smiles
C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)O
Isomeric SMILES
C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)O
WGK Germany
3
RTECS
AR7190000
Molecular Weight
253.25
Beilstein
227508
Reaxy-Rn
227508
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=227508&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Soluble in DMF
Melt Point(°C)
289°C
Molecular Weight
253.250 g/mol
XLogP3
2.700
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
253.074 Da
Monoisotopic Mass
253.074 Da
Topological Polar Surface Area
57.600 Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
356.000
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
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