3-Pyridinecarboxamide,2-phenoxy- supplier

Name
2-PHENOXYNICOTINAMIDE
EINECS
CAS No. 111950-69-7
Density 1.245 g/cm³
Solubility
Melting Point 162-163 °C
Formula C₁₂H₁₀N₂O₂
Boiling Point 392.7 °C at 760 mmHg
Molecular Weight 214.224
Flash Point 191.3 °C
Transport Information
Appearance
Safety
Risk Codes Xi:Irritant;
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Phenoxynicotinamide;
PSA 65.21000
LogP 2.67310

3-Pyridinecarboxamide,2-phenoxy- Specification

The 3-Pyridinecarboxamide, 2-phenoxy-, with the CAS registry number of 111950-69-7, is also known as 2-Phenoxynicotinamide. This chemical's molecular formula is C₁₂H₁₀N₂O₂ and molecular weight is 214.22. What's more, its systematic name is 2-Phenoxypyridine-3-carboxamide. In addition, this chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about 3-Pyridinecarboxamide, 2-phenoxy- are: (1)ACD/LogP: 1.37; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.37; (4)ACD/LogD (pH 7.4): 1.37; (5)ACD/BCF (pH 5.5): 6.44; (6)ACD/BCF (pH 7.4): 6.44; (7)ACD/KOC (pH 5.5): 132.02; (8)ACD/KOC (pH 7.4): 132.02; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 42.43 Å²; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 59.71 cm³; (15)Molar Volume: 171.9 cm³; (16)Surface Tension: 54.4 dyne/cm; (17)Density: 1.245 g/cm³; (18)Flash Point: 191.3 °C; (19)Enthalpy of Vaporization: 64.25 kJ/mol; (20)Boiling Point: 392.7 °C at 760 mmHg; (21)Vapour Pressure: 2.25E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c2cccnc2Oc1ccccc1)N
(2) InChI: InChI=1/C12H10N2O2/c13-11(15)10-7-4-8-14-12(10)16-9-5-2-1-3-6-9/h1-8H,(H2,13,15)
(3) InChIKey: FTBCRRFSFTVINJ-UHFFFAOYAG

Product Name

2-PHENOXYNICOTINAMIDE

3-Pyridinecarboxamide,2-phenoxy- Specification

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