2-Phenyl-1-pyridin-3-yl-ethanone supplier

Name
2-PHENYL-1-PYRIDIN-3-YL-ETHANONE
EINECS
CAS No. 14627-92-0
Article Data11
CAS DataBase
Density 1.128 g/cm³
Solubility
Melting Point
Formula C₁₃H₁₁NO
Boiling Point 352.638 °C at 760 mmHg
Molecular Weight 197.236
Flash Point 174.911 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Phenyl-1-(3-pyridinyl)ethanone;3-(Phenylacetyl)pyridine;3-Pyridyl benzyl ketone;Benzyl 3-pyridyl ketone;Ketone,benzyl 3-pyridyl (7CI,8CI);
PSA 29.96000
LogP 2.50700

2-Phenyl-1-pyridin-3-yl-ethanone Specification

This chemical is called Ethanone, 2-phenyl-1-(3-pyridinyl)-, and its systematic name is 2-phenyl-1-pyridin-3-ylethanone. With the molecular formula of C₁₃H₁₁NO, its molecular weight is 197.23. The CAS registry number of this chemical is 14627-92-0.

Other characteristics of the Ethanone, 2-phenyl-1-(3-pyridinyl)- can be summarised as followings: (1)ACD/LogP: 1.98; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.98; (4)ACD/LogD (pH 7.4): 1.98; (5)ACD/BCF (pH 5.5): 18.85; (6)ACD/BCF (pH 7.4): 18.94; (7)ACD/KOC (pH 5.5): 284.42; (8)ACD/KOC (pH 7.4): 285.75; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 29.96 Å²; (13)Index of Refraction: 1.588; (14)Molar Refractivity: 58.85 cm³; (15)Molar Volume: 174.8 cm³; (16)Polarizability: 23.33×10^-24cm³; (17)Surface Tension: 47.3 dyne/cm; (18)Density: 1.127 g/cm³; (19)Flash Point: 174.9 °C; (20)Enthalpy of Vaporization: 59.75 kJ/mol; (21)Boiling Point: 352.6 °C at 760 mmHg; (22)Vapour Pressure: 3.79E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(c1cccnc1)Cc2ccccc2
2.InChI: InChI=1/C13H11NO/c15-13(12-7-4-8-14-10-12)9-11-5-2-1-3-6-11/h1-8,10H,9H2
3.InChIKey: GVEQCFMNUYFHOE-UHFFFAOYAS

Product Name

2-PHENYL-1-PYRIDIN-3-YL-ETHANONE

2-Phenyl-1-pyridin-3-yl-ethanone Specification

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