Tetryzoline - ≥98% , CAS No.84-22-0

CAS: 84-22-0 Cat. No.: T413318 Formula: C₁₃H₁₆N₂ Peso molecolare: 200.28 Numero EC: 201-522-3 PubChem CID: 5419

QUALITÀ & PUREZZA ≥98%

Synonyms

NINDS_000854 | 5-23-07-00394 (Beilstein Handbook Reference) | HMS3561J13 | Prestwick0_000698 | NCGC00016018-19 | UNII-S9U025Y077 | (-)-Tetrahydrozoline | HSDB 7471 | rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline | 1H-Imidazole, 4,5-dihydro-2-(1,2,3,

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Panoramica

Information

Tetryzoline Tetryzoline (Tetrahydrozoline) is an alpha-adrenergic agonist used in some over-the-counter eye drops and nasal sprays.

Specifiche

Sinonimi

NINDS_000854 | 5-23-07-00394 (Beilstein Handbook Reference) | HMS3561J13 | Prestwick0_000698 | NCGC00016018-19 | UNII-S9U025Y077 | (-)-Tetrahydrozoline | HSDB 7471 | rac-2-(1,2,3,4-tetrahydro-1-naphthyl)-2-imidazoline | 1H-Imidazole, 4,5-dihydro-2-(1,2,3,

Specifiche e purezza

≥98%

Meccanismi biochimici e fisiologici

Tetryzoline (Tetrahydrozoline) is an alpha-adrenergic agonist used in some over-the-counter eye drops and nasal sprays.

Condizioni di conservazione di stoccaggio

Store at -20°C

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Tipo di azione

AGONIST

Purezza

≥98%

Proprietà del prodotto

ALogP

2.185

Conteggio HBD

1

Legame rotabile

1

Nomi e identificatori

Pubchem Sid

504750888

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504750888

Sorrisi canonici

C1CC(C2=CC=CC=C2C1)C3=NCCN3

IUPAC Name

2-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole

InChIKey

BYJAVTDNIXVSPW-UHFFFAOYSA-N

INCHI

1S/C13H16N2/c1-2-6-11-10(4-1)5-3-7-12(11)13-14-8-9-15-13/h1-2,4,6,12H,3,5,7-9H2,(H,14,15)

Isomeri SMILES

C1CC(C2=CC=CC=C2C1)C3=NCCN3

PubChem CID

5419

Peso molecolare

200.28

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Tetralins

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Tetralins
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Tetralins
• Alternative Parents: Imidolactams Imidazolines Propargyl-type 1,3-dipolar organic compounds Carboximidamides Carboxamidines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Tetralin - Imidolactam - 2-imidazoline - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid amidine - Amidine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
• External Descriptors: carboxamidine - imidazolines

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

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Solubility (25°C) In vitro DMSO: 40 mg/mL (199.72 mM); Ethanol: -1 mg/mL
• DMSO (mg/mL) Solubilità massima: 40
• DMSO (mM) Solubilità massima: 199.720391451967
• Acqua (mg/mL) Solubilità massima: -1
• Peso molecolare: 200.280 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 200.131 Da
• Monoisotopic Mass: 200.131 Da
• Topological Polar Surface Area: 24.400 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 259.000
• 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: 1