Ethacridine lactate monohydrate - ≥99% , CAS No.6402-23-9

CAS: 6402-23-9 Cat. No.: D129570 Peso molecular: 361.39 Beilstein Registry Number: 3642805 Número EC: 642-272-9

GRADE & PURITY ≥99%

Synonyms

Acrinol Monohydrate | 6,9-Diamino-2-ethoxyacridine lactate monohydrate

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Descripción general

Ethacridine lactate monohydrate is an aromatic organic compound based on acridine used as an antiseptic agent.
An antiseptic agent that makes an effective abortifacient

Specifications

Sinónimos

Acrinol Monohydrate | 6, 9-Diamino-2-ethoxyacridine lactate monohydrate

Especificaciones y pureza

≥99%

Mecanismos bioquímicos y fisiológicos

DNA intercalating antiseptic agent. Activates uterine mast cells. Induces myometrial contractions (EC 50 = 10 μM). Shows abortifacient effects in vivo.

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Nota

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Pureza

≥99%

Nombres e identificadores

• Pubchem Sid: 504757576
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757576
• Sonrisas canónicas: CCOC1=CC2=C(C3=C(C=C(C=C3)N)N=C2C=C1)N.CC(C(=O)O)O.O
• IUPAC Name: 7-ethoxyacridine-3,9-diamine;2-hydroxypropanoic acid;hydrate
• InChIKey: NYEPHMYJRNWPLA-UHFFFAOYSA-N
• INCHI: 1S/C15H15N3O.C3H6O3.H2O/c1-2-19-10-4-6-13-12(8-10)15(17)11-5-3-9(16)7-14(11)18-13;1-2(4)3(5)6;/h3-8H,2,16H2,1H3,(H2,17,18);2,4H,1H3,(H,5,6);1H2
• Isómeros SMILES: CCOC1=CC2=C(C3=C(C=C(C=C3)N)N=C2C=C1)N.CC(C(=O)O)O.O
• WGK Alemania: 3
• RTECS: OD4725000
• Peso molecular: 361.39
• Beilstein: 3642805
• Reaxy-Rn: 15877846
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15877846&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Quinolines and derivatives
      • Subclass Benzoquinolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Quinolines and derivatives
• Subclass: Benzoquinolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Acridines
• Alternative Parents: 4-aminoquinolines Aminopyridines and derivatives Alkyl aryl ethers Benzenoids Alpha hydroxy acids and derivatives Heteroaromatic compounds Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Acridine - 4-aminoquinoline - Aminoquinoline - Alkyl aryl ether - Aminopyridine - Alpha-hydroxy acid - Benzenoid - Pyridine - Hydroxy acid - Heteroaromatic compound - Secondary alcohol - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organopnictogen compound - Organic oxygen compound - Alcohol - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as acridines. These are organic compounds containing the acridine moiety, a linear tricyclic heterocycle which consists of two benzene rings joined by a pyridine ring.
• 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.

DOI: 10.1186/s13321-016-0174-y

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in water, and alcohol.
• Sensibilidad: Light sensitive
• Punto de fusión (°C): 243-245 °C
• Peso molecular: 361.400 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 361.164 Da
• Monoisotopic Mass: 361.164 Da
• Topological Polar Surface Area: 133.000 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 371.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 3

XLogP3