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4-Methylpyridine-2-carbaldehyde

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Name

4-Methylpyridine-2-carbaldehyde

EINECS N/A
CAS No. 53547-60-7 Density 1.095 g/cm3
PSA 29.96000 LogP 1.20250
Solubility N/A Melting Point N/A
Formula C7H7NO Boiling Point 208.8 °C at 760 mmHg
Molecular Weight 121.139 Flash Point 84.258 °C
Transport Information N/A Appearance N/A
Safety Risk Codes 22
Molecular Structure Molecular Structure of 53547-60-7 (2-FORMYL-4-PICOLINE) Hazard Symbols Xi
Synonyms

Picolinaldehyde,4-methyl- (6CI);4-Methyl-2-pyridinecarboxaldehyde;

Article Data 17

4-Methylpyridine-2-carbaldehyde Specification

The 4-Methylpyridine-2-carbaldehyde, with the CAS registry number 53547-60-7, is also known as 2-Pyridinecarboxaldehyde, 4-methyl-. Its molecular formula is C7H7NO and its molecular weight is 121.14. Additionally, its product categories are Pyridine; Pyridine Series; Aldehydes; Boronic Acid. For it's harmful, be careful if you use it.

Other characteristics of the 4-Methylpyridine-2-carbaldehyde can be summarised as followings: (1)ACD/LogP: 1.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 3; (6)ACD/BCF (pH 7.4): 3; (7)ACD/KOC (pH 5.5): 67; (8)ACD/KOC (pH 7.4): 73; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 29.96 Å2; (13)Index of Refraction: 1.563; (14)Molar Refractivity: 35.922 cm3; (15)Molar Volume: 110.598 cm3; (16)Polarizability: 14.241×10-24cm3; (17)Surface Tension: 43.555 dyne/cm; (18)Density: 1.095 g/cm3; (19)Flash Point: 84.258 °C; (20)Enthalpy of Vaporization: 44.506 kJ/mol; (21)Boiling Point: 208.8 °C at 760 mmHg; (22)Vapour Pressure: 0.21 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=Cc1nccc(c1)C
2.InChI: InChI=1/C7H7NO/c1-6-2-3-8-7(4-6)5-9/h2-5H,1H3
3.InChIKey: UAKMHSRHDUBNJR-UHFFFAOYAZ

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