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Basic Information
CAS No.: 51746-85-1
Name: 3-(1H-Imidazol-4-yl)pyridine
Article Data: 17
Molecular Structure:
Molecular Structure of 51746-85-1 (3-(1H-Imidazol-4-yl)pyridine)
Formula: C8H7N3
Molecular Weight: 145.164
Synonyms: Pyridine,3-(1H-imidazol-4-yl)- (9CI);3-(1H-Imidazol-4-yl)pyridine;4-(3-Pyridyl)imidazole;
EINECS: 610-720-2
Density: 1.214 g/cm3
Melting Point: 117-118°C
Boiling Point: 422.4 °C at 760 mmHg
Flash Point: 214.5 °C
Appearance: Light yellow solid
PSA: 41.57000
LogP: 1.47170
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    3-(1H-Imidazol-4-yl)pyridine

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    Molecular Formula: C8H7N3 Formula Weight: 145.16

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  • 3-(1H-Imidazol-4-yl)pyridine

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    51746-85-1

    3-(1H-Imidazol-4-yl)pyridine

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Chemistry

 

Molecule structure of 3-(1H-Imidazol-4-yl)pyridine (CAS NO.51746-85-1):

IUPAC Name: 3-(1H-Imidazol-5-yl)pyridine 
Molecular Weight: 145.16128 g/mol
Molecular Formula: C8H7N3 
Density: 1.214 g/cm3 
Melting Point: 117-118 °C
Boiling Point: 422.4 °C at 760 mmHg 
Flash Point: 214.5 °C
Index of Refraction: 1.61
Molar Refractivity: 41.46 cm3
Molar Volume: 119.4 cm3
Surface Tension: 57.1 dyne/cm 
Enthalpy of Vaporization: 65.04 kJ/mol
Vapour Pressure: 5.94E-07 mmHg at 25 °C
XLogP3-AA: 0.7
H-Bond Donor: 1
H-Bond Acceptor: 2
Rotatable Bond Count: 1
Tautomer Count: 2
Exact Mass: 145.063997
MonoIsotopic Mass: 145.063997
Topological Polar Surface Area: 41.6
Heavy Atom Count: 11
Canonical SMILES: C1=CC(=CN=C1)C2=CN=CN2
InChI: InChI=1S/C8H7N3/c1-2-7(4-9-3-1)8-5-10-6-11-8/h1-6H,(H,10,11)
InChIKey: YFOKBFRTGLSZLU-UHFFFAOYSA-N
Product Categories: Heterocycles; Miscellaneous Reagents

Uses

 3-(1H-Imidazol-4-yl)pyridine (CAS NO.51746-85-1) is imidazole rings found in numberous natural compounds such as enzymes, nucleic acid, and alkaloids that play a role in biological processes.

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 250mg/kg (250mg/kg) BEHAVIORAL: GENERAL ANESTHETIC

BEHAVIORAL: EXCITEMENT

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES		 Quarterly Journal of Pharmacy & Pharmacology. Vol. 12, Pg. 260, 1939.

Specification

 3-(1H-Imidazol-4-yl)pyridine (CAS NO.51746-85-1) is also named as 4-(3-Pyridyl)imidazole ; 4-26-00-00176 (Beilstein Handbook Reference) ; 5(4)-3'-Pyridyl-glyoxaline ; BRN 0003724 ; Pyridine, 3-(1H-imidazol-4-yl)- .  3-(1H-Imidazol-4-yl)pyridine (CAS NO.51746-85-1) is light yellow solid.