4-Aminochromane Hydrochloride - ≥96% , CAS No.90609-63-5

CAS: 90609-63-5 Cat. No.: C188014 Peso molecular: 185.65 Número EC: 962-726-2

GRADE & PURITY ≥96%

Synonyms

Chroman-4-ylamine, HCl | DTXSID50920284 | 4-Aminochromane HCl | (S)-4-Aminochromane Hydrochloride | CHROMAN-4-YL-AMMONIUMCHLORIDE | SR-01000395795 | Chroman-4-ylamine hydrochloride, AldrichCPR | FT-0601880 | 4-chromanylamine hydrochloride | SB30307 | SCHE

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

Chroman-4-ylamine, HCl | DTXSID50920284 | 4-Aminochromane HCl | (S)-4-Aminochromane Hydrochloride | CHROMAN-4-YL-AMMONIUMCHLORIDE | SR-01000395795 | Chroman-4-ylamine hydrochloride, AldrichCPR | FT-0601880 | 4-chromanylamine hydrochloride | SB30307 | SCHE

Especificaciones y pureza

≥96%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light, Argon charged

Enviado en

Wet ice

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

Pureza

≥96%

Nombres e identificadores

• Sonrisas canónicas: C1COC2=CC=CC=C2C1N.Cl
• IUPAC Name: 3,4-dihydro-2H-chromen-4-amine;hydrochloride
• InChIKey: BVMKYKMJUZEGBU-UHFFFAOYSA-N
• INCHI: 1S/C9H11NO.ClH/c10-8-5-6-11-9-4-2-1-3-7(8)9;/h1-4,8H,5-6,10H2;1H
• Isómeros SMILES: C1COC2=CC=CC=C2C1N.Cl
• CAS alternativo: 188198-38-1；210488-55-4；53981-38-7；730980-59-3
• Peso molecular: 185.65
• Reaxy-Rn: 13483060
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13483060&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Benzopyrans
      • Subclass 1-benzopyrans

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Benzopyrans
• Subclass: 1-benzopyrans
• Intermediate Tree Nodes: Not available
• Direct Parent: 1-benzopyrans
• Alternative Parents: Aralkylamines Alkyl aryl ethers Benzenoids Quaternary ammonium salts Oxacyclic compounds Organic chloride salts Monoalkylamines Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 1-benzopyran - Alkyl aryl ether - Aralkylamine - Benzenoid - Quaternary ammonium salt - Oxacycle - Ether - Organic chloride salt - Amine - Organic salt - Organic nitrogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
• 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

Propiedades químicas y físicas

• Sensibilidad: light & Moisture sensitive
• Peso molecular: 185.650 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 185.061 Da
• Monoisotopic Mass: 185.061 Da
• Topological Polar Surface Area: 35.300 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 138.000
• 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: 2

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