CAS No.38609-97-1,9-Oxo-10(9H)-acridineacetic acid Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	38609-97-1
Name:	9-Oxo-10(9H)-acridineacetic acid
Article Data:	12
Cas Database

Formula:	C₁₅H₁₁NO₃
Molecular Weight:	253.257
Synonyms:	10-Carboxymethyl-9-acridanone;Cridanimod;N-(Carboxymethyl)acridone;BRN 0227508;Cycloferon;Cyclopheron;UNII-X91E9EME19;
EINECS:	634-833-1
Density:	1.362 g/cm³
Melting Point:	~289 °C (dec.)
Boiling Point:	486.6 °C at 760 mmHg
Flash Point:	248.1 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26
PSA:	59.30000
LogP:	2.23930

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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.