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1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID

CAS 13593-94-7C10H7NO3MW 189.17

1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID (CAS 13593-94-7) — formula C10H7NO3, molecular weight 189.17; category organic chemicals.

Product Overview

CAS Number13593-94-7
Molecular FormulaC10H7NO3
Molecular Weight189.17
Melting Point280 °C
LogP1.3
ApplicationsUses: A metabolite of tryptophan found in the urine of some animals, Used in nutritional studies of vitamin B deficiency, [Merck Index] A broad-spectrum excitatory amino acid antagonist used as a research tool. [ChemIDplus], Naturally produced by the body (endogenous).
CategoryOrganic Chemicals

Applications

Documented applications: Uses: A metabolite of tryptophan found in the urine of some animals, Used in nutritional studies of vitamin B deficiency, [Merck Index] A broad-spectrum excitatory amino acid antagonist used as a research tool. [ChemIDplus], Naturally produced by the body (endogenous)..

Technical Profile

What this product is

1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID is a carbon-based organic compound with CAS registry number 13593-94-7 and molecular formula C10H7NO3 (molecular weight 189.17), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 13593-94-7

Its molecular formula C10H7NO3 comprises 10 C, 7 H, 1 N, 3 O atoms.

Also known as: 1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID · 1,4-二氢-4-氧代喹啉-2-羧酸

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID?

The CAS registry number of 1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID is 13593-94-7.

What is the molecular formula and molecular weight of 1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID?

Molecular formula C10H7NO3, molecular weight 189.17.

What other names is 1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID known by?

It is also registered under: 1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID, 1,4-二氢-4-氧代喹啉-2-羧酸.

What are the documented applications of 1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID?

Recorded applications: Uses: A metabolite of tryptophan found in the urine of some animals, Used in nutritional studies of vitamin B deficiency, [Merck Index] A broad-spectrum excitatory amino acid antagonist used as a research tool. [ChemIDplus], Naturally produced by the body (endogenous)..

Which category does 1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID (CAS 13593-94-7), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number13593-94-7
PubChem CID3845
Molecular formulaC10H7NO3
IUPAC name4-oxo-1H-quinoline-2-carboxylic acid
UNII (FDA)H030S2S85J

Computed descriptors

Molecular Weight189.17
XLogP31.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass189.042593085
Monoisotopic Mass189.042593085
Topological Polar Surface Area66.4
Heavy Atom Count14

Physicochemical values on record

Melting Point280 °C
Collision Cross Section136.6 Ų [M+H]+
Collision Cross Section151.2 Ų [M+Na]+
Collision Cross Section135.3 Ų [M-H]-

Documented uses on record

    A metabolite of tryptophan found in the urine of some animals; Used in nutritional studies of vitamin B deficiency; [Merck Index] A broad-spectrum excitatory amino acid antagonist used as a research tool. [ChemIDplus]Naturally produced by the body (endogenous).

    Synonyms and trade names

    kynurenic acid; 492-27-3; 4-Hydroxyquinoline-2-carboxylic acid; Kinurenic acid; Kynuronic acid; Quinurenic acid; 4-Hydroxyquinaldic acid; 2-Quinolinecarboxylic acid, 4-hydroxy-; 4-Hydroxy-2-quinolinecarboxylic acid; 4-Hydroxyquinaldinic acid; 4-oxo-1H-quinoline-2-carboxylic acid; NSC-58973; CHEBI:18344; H030S2S85J; DTXSID8075417; Acid, Kynurenic

    GHS hazard classification

    Reported hazard statementsH315 (100%), H319 (100%), H335 (97.4%)

    H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

    H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

    What the public record says

    1,4-DIHYDRO-4-OXOQUINOLINE-2-CARBOXYLIC ACID · CAS 13593-94-7 · C10H7NO3. UNII H030S2S85J. Melting Point: 280 °C; Collision Cross Section: 136.6 Ų [M+H]+; Collision Cross Section: 151.2 Ų [M+Na]+.

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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