3-Benzhydrylpyridine , CAS No.3678-71-5

CAS: 3678-71-5 Cat. No.: B667973 Molecular Weight: 245.3 EC Number: 222-954-9

Synonyms

3-Benzhydrylpyridine | 3-Benzhydryl-pyridine | diphenyl-3-pyridylmethane | MLS002693295 | Pyridine, 3-(diphenylmethyl)- | NSC-60654 | 3-(diphenylmethyl)pyridine | NSC60654 | EINECS 222-954-9 | 3-Benzhydrylpyridine # | 3-diphenylmethylpyridine | L7GLC7F3XR

Storage

Room temperature

Specifications

Synonyms

3-Benzhydrylpyridine | 3-Benzhydryl-pyridine | diphenyl-3-pyridylmethane | MLS002693295 | Pyridine, 3-(diphenylmethyl)- | NSC-60654 | 3-(diphenylmethyl)pyridine | NSC60654 | EINECS 222-954-9 | 3-Benzhydrylpyridine # | 3-diphenylmethylpyridine | L7GLC7F3XR

Storage

Room temperature

Product Properties

• ALogP: 4.2

Names and Identifiers

• Canonical Smiles: C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CN=CC=C3
• IUPAC Name: 3-benzhydrylpyridine
• InChIKey: HGVLJGHVYCBNBB-UHFFFAOYSA-N
• INCHI: 1S/C18H15N/c1-3-8-15(9-4-1)18(16-10-5-2-6-11-16)17-12-7-13-19-14-17/h1-14,18H
• Isomeric SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CN=CC=C3
• Molecular Weight: 245.3
• Reaxy-Rn: 156995
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=156995&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Diphenylmethanes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Diphenylmethanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylmethanes
• Alternative Parents: Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Diphenylmethane - Pyridine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
• 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

Mechanisms of Action