isoquinolin-6-amine - ≥97% , CAS No.23687-26-5

CAS: 23687-26-5 Cat. No.: I175855 Formula: C₉H₈N₂ Peso molecolare: 144.17 Numero EC: 639-440-9

GRADE & PURITY ≥97%

Synonyms

SY021134 | EN300-91889 | AM20061843 | isoquinolin-6-amine | 6-aminoisoquinoline, AldrichCPR | PERPHENAZINESULFOXIDE(100MG) | 6-Aminoisoquinoline | BDBM50126281 | 6-Isoquinolinamine | AKOS006229814 | BP6NQZ58UP | A26442 | DTXSID70343315 | FT-0647924 | Isoq

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

SY021134 | EN300-91889 | AM20061843 | isoquinolin-6-amine | 6-aminoisoquinoline, AldrichCPR | PERPHENAZINESULFOXIDE(100MG) | 6-Aminoisoquinoline | BDBM50126281 | 6-Isoquinolinamine | AKOS006229814 | BP6NQZ58UP | A26442 | DTXSID70343315 | FT-0647924 | Isoq

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥97%

Nomi e identificatori

Pubchem Sid

504759397

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504759397

Sorrisi canonici

C1=CC2=C(C=CN=C2)C=C1N

IUPAC Name

isoquinolin-6-amine

InChIKey

NGFCTYXFMDWFRQ-UHFFFAOYSA-N

INCHI

1S/C9H8N2/c10-9-2-1-8-6-11-4-3-7(8)5-9/h1-6H,10H2

Isomeri SMILES

C1=CC2=C(C=CN=C2)C=C1N

Peso molecolare

144.17

Reaxy-Rn

113334

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=113334&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Quinolines and derivatives
      • Subclass Aminoquinolines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Quinolines and derivatives
• Subclass: Aminoquinolines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminoquinolines and derivatives
• Alternative Parents: Isoquinolines and derivatives Pyridines and derivatives Benzenoids Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Aminoquinoline - Isoquinoline - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as aminoquinolines and derivatives. These are organic compounds containing an amino group attached to a quinoline ring system.
• 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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Peso molecolare: 144.170 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 144.069 Da
• Monoisotopic Mass: 144.069 Da
• Topological Polar Surface Area: 38.900 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 136.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Domande frequenti

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 23687-26-5, the molecular formula is C9H8N2, and the molecular weight is 144.17 g/mol. InChIKey NGFCTYXFMDWFRQ-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.