4-Chlorofuro[3,2-c]pyridine hcl - ≥95% , CAS No.1187830-64-3

CAS: 1187830-64-3 Cat. No.: C179969 Molecular Weight: 190 PubChem CID: 56776992

GRADE & PURITY ≥95%

Synonyms

4-Chlorofuro[3,2-c]pyridine hydrochloride|1187830-64-3|4-CHLOROFURO[3,2-C]PYRIDINE HCL|4-chlorofuro[3,2-c]pyridine;hydrochloride|4-Chlorofuro[3,2-c]pyridinehydrochloride|DTXSID60718472|MFCD12400780|SC2121|AKOS015919597|BS-25039|4-Chlorofuro[3,2-c]pyridine

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

4-Chlorofuro[3, 2-c]pyridine hydrochloride | 1187830-64-3 | 4-CHLOROFURO[3, 2-C]PYRIDINE HCL | 4-chlorofuro[3, 2-c]pyridine;hydrochloride | 4-Chlorofuro[3, 2-c]pyridinehydrochloride | DTXSID60718472 | MFCD12400780 | SC2121 | AKOS015919597 | BS-25039 | 4-Chlorofuro[3, 2-c]pyridine

Specifications & Purity

≥95%

Storage

Room temperature

Shipped In

Normal

Purity

≥95%

Names and Identifiers

• Canonical Smiles: C1=CN=C(C2=C1OC=C2)Cl.Cl
• IUPAC Name: 4-chlorofuro[3,2-c]pyridine;hydrochloride
• InChIKey: NJGPVZNZLKZTAK-UHFFFAOYSA-N
• INCHI: 1S/C7H4ClNO.ClH/c8-7-5-2-4-10-6(5)1-3-9-7;/h1-4H;1H
• Isomeric SMILES: C1=CN=C(C2=C1OC=C2)Cl.Cl
• PubChem CID: 56776992
• Molecular Weight: 190

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Furopyridines
      • Subclass Furo[3,2-c]pyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Furopyridines
• Subclass: Furo[3,2-c]pyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Furo[3,2-c]pyridines
• Alternative Parents: 2-halopyridines Aryl chlorides Heteroaromatic compounds Furans Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Furo[3,2-c]pyridine - 2-halopyridine - Aryl chloride - Aryl halide - Pyridine - Furan - Heteroaromatic compound - Oxacycle - Azacycle - Organic nitrogen compound - Hydrochloride - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as furo[3,2-c]pyridines. These are aromatic compounds containing a furopyridine ring system, where the O- and the N-atom are at the 1- and 5- position, respectively.
• 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

Chemical and Physical Properties

• Molecular Weight: 190.020 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 188.975 Da
• Monoisotopic Mass: 188.975 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 131.000
• 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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