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9-Oxo-10(9H)-acridineacetic acid

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Name

9-Oxo-10(9H)-acridineacetic acid

EINECS 634-833-1
CAS No. 38609-97-1 Density 1.362 g/cm3
PSA 59.30000 LogP 2.23930
Solubility N/A Melting Point ~289 °C (dec.)
Formula C15H11NO3 Boiling Point 486.6 °C at 760 mmHg
Molecular Weight 253.257 Flash Point 248.1 °C
Transport Information N/A Appearance N/A
Safety 26 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 38609-97-1 (9-Oxo-10(9H)-acridineacetic acid) Hazard Symbols IrritantXi
Synonyms

10-Carboxymethyl-9-acridanone;Cridanimod;N-(Carboxymethyl)acridone;BRN 0227508;Cycloferon;Cyclopheron;UNII-X91E9EME19;

Article Data 12

9-Oxo-10(9H)-acridineacetic acid Specification

The 10(9H)-Acridineaceticacid, 9-oxo- with CAS registry number of 38609-97-1 is also known as 9-Oxo-10(9H)-acridineacetic acid. The IUPAC name is 2-(9-Oxoacridin-10-yl)acetic acid. In addition, the formula is C15H11NO3 and the molecular weight is 253.25.

Physical properties about 10(9H)-Acridineaceticacid, 9-oxo- are: (1)XLogP3-AA: 2.7; (2)H-Bond Donor: 1; (3)H-Bond Acceptor: 4; (4)Rotatable Bond Count: 2; (5)Exact Mass: 253.073893; (6)MonoIsotopic Mass: 253.073893; (7)Topological Polar Surface Area: 57.6; (8)Heavy Atom Count: 19; (9)Complexity: 356; (10)Covalently-Bonded Unit Count: 1.

Preparation of 10(9H)-Acridineaceticacid, 9-oxo-: it is prepared by reaction of 2-(9-oxo-9H-acridin-10-yl)-acetamide. The reaction needs reagent KOH and solvent butan-1-ol with other condition of heating for 5 hours. The yield is about 86%.

10(9H)-Acridineaceticacid, 9-oxo- is prepared by reaction of 2-(9-oxo-9H-acridin-10-yl)-acetamide.

Uses of 10(9H)-Acridineaceticacid, 9-oxo-: it is used to produce (9-oxo-9H-acridin-10-yl)-acetic acid methyl ester by reaction with methanol. The reaction occurs with reagent H2SO4 and solvent ethanol with other condition of heating for 5 hours. The yield is about 71%.

10(9H)-Acridineaceticacid, 9-oxo- is used to produce (9-oxo-9H-acridin-10-yl)-acetic acid methyl ester by reaction with methanol.

When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes, respiratory system and skin. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)O
2. 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)
3. InChIKey: UOMKBIIXHQIERR-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
hamster LD50 intraperitoneal 1022mg/kg (1022mg/kg)   Drugs of the Future. Vol. 6, Pg. 408, 1981.

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