2,2':6',2''-Terpyridine,4'-methyl- supplier

Name
4'-METHYL-2,2':6',2''-TERPYRIDINE
EINECS
CAS No. 72036-41-0
Article Data10
CAS DataBase
Density 1.145 g/cm³
Solubility
Melting Point
Formula C₁₆H₁₃N₃
Boiling Point 401.464 °C at 760 mmHg
Molecular Weight 247.299
Flash Point 178.511 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4'-Methyl-2,2':6',2''-terpyridine;
PSA 38.67000
LogP 3.51400

2,2':6',2''-Terpyridine,4'-methyl- Specification

The 2,2':6',2''-Terpyridine,4'-methyl-, also known as 4'-Methyl-2,2':6',2''-terpyridin, is the organic compound with the formula C₁₆H₁₃N₃. With the CAS registry number 72036-41-0, its systematic name is called 4'-methyl-2,2':6',2''-terpyridine.

Physical properties of 2,2':6',2''-Terpyridine,4'-methyl-: (1)ACD/LogP: 2.67; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 48; (5)ACD/BCF (pH 7.4): 55; (6)ACD/KOC (pH 5.5): 538; (7)ACD/KOC (pH 7.4): 609; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.607; (11)Molar Refractivity: 74.535 cm³; (12)Molar Volume: 215.949 cm³; (13)Surface Tension: 49.943 dyne/cm; (14)Density: 1.145 g/cm³; (15)Flash Point: 178.511 °C; (16)Enthalpy of Vaporization: 62.706 kJ/mol; (17)Boiling Point: 401.464 °C at 760 mmHg; (18)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(nc(c1)c2ccccn2)c3ccccn3
(2)InChI: InChI=1/C16H13N3/c1-12-10-15(13-6-2-4-8-17-13)19-16(11-12)14-7-3-5-9-18-14/h2-11H,1H3
(3)InChIKey: UZUDKOHDONKQCH-UHFFFAOYAD

Product Name

4'-METHYL-2,2':6',2''-TERPYRIDINE

2,2':6',2''-Terpyridine,4'-methyl- Specification

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