4-Chloroisoindoline hydrochloride - ≥98% , CAS No.924304-73-4

CAS: 924304-73-4 Cat. No.: C195868 Formula: C₈H₉Cl₂N Peso molecolare: 190.07 Numero EC: 870-669-9 PubChem CID: 42609644

GRADE & PURITY ≥98%

Synonyms

4-chloro-2,3-dihydro-1h-isoindole;hydrochloride | AKOS015900640 | EN300-214128 | 4-Chloroisoindoline hydrochloride | 4-Chloro-2,3-dihydro-1H-isoindole--hydrogen chloride (1/1) | 4-chloroisoindoline hydrogen chloride | 1H-isoindole,4-chloro-2,3-dihydro-,hy

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinonimi

4-chloro-2,3-dihydro-1h-isoindole;hydrochloride | AKOS015900640 | EN300-214128 | 4-Chloroisoindoline hydrochloride | 4-Chloro-2,3-dihydro-1H-isoindole--hydrogen chloride (1/1) | 4-chloroisoindoline hydrogen chloride | 1H-isoindole,4-chloro-2,3-dihydro-,hy

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

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

Purezza

≥98%

Nomi e identificatori

• Sorrisi canonici: C1C2=C(CN1)C(=CC=C2)Cl.Cl
• IUPAC Name: 4-chloro-2,3-dihydro-1H-isoindole;hydrochloride
• InChIKey: BHGGKDRWZHDWRI-UHFFFAOYSA-N
• INCHI: 1S/C8H8ClN.ClH/c9-8-3-1-2-6-4-10-5-7(6)8;/h1-3,10H,4-5H2;1H
• Isomeri SMILES: C1C2=C(CN1)C(=CC=C2)Cl.Cl
• PubChem CID: 42609644
• Peso molecolare: 190.07

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Isoindoles and derivatives
      • Subclass Isoindoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Isoindoles and derivatives
• Subclass: Isoindoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Isoindoles
• Alternative Parents: Isoindolines Aralkylamines Benzenoids Aryl chlorides Dialkylamines Azacyclic compounds Organochlorides Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Isoindoline - Isoindole - Aralkylamine - Aryl chloride - Aryl halide - Benzenoid - Secondary aliphatic amine - Azacycle - Secondary amine - Organohalogen compound - Hydrochloride - Amine - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as isoindoles. These are heteropolycyclic compounds with a structure containing isoindole, a benzo-fused pyrrole.
• 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

Proprietà chimiche e fisiche

• Sensibilità: Moisture sensitive
• Peso molecolare: 190.070 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 189.011 Da
• Monoisotopic Mass: 189.011 Da
• Topological Polar Surface Area: 12.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 126.000
• 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: 2

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