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55589-47-4

Basic Information
CAS No.: 55589-47-4
Name: 3-METHYL-2-PYRIDINECARBOXALDEHYDE
Article Data: 14
Molecular Structure:
Molecular Structure of 55589-47-4 (3-METHYL-2-PYRIDINECARBOXALDEHYDE)
Formula: C7H7NO
Molecular Weight: 121.139
Synonyms: Picolinaldehyde,3-methyl- (6CI);3-Methyl-2-pyridinecarboxaldehyde;
Density: 1.095 g/cm3
Melting Point: 8°C(lit.)
Boiling Point: 207 °C at 760 mmHg
Flash Point: 83 °C
Solubility: Slightly soluble in water.
Hazard Symbols: HarmfulXn,IrritantXi
Risk Codes: 36/37/38-22
Safety: 26-36/37/39
PSA: 29.96000
LogP: 1.20250
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    3-Methylpicolinaldehyde

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    55589-47-4

    3-methyl-2-pyridineformaldehyde

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  • 3-METHYL-2-PYRIDINECARBOXALDEHYDE

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    55589-47-4

    3-METHYL-2-PYRIDINECARBOXALDEHYDE

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  • Manufacturer of 3-Methyl-2-pyridinecarbaldehyde at Factory Price CAS NO.55589-47-4

  • Casno:

    55589-47-4

    Manufacturer of 3-Methyl-2-pyridinecarbaldehyde at Factory Price CAS NO.55589-47-4

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  • 3-Methylpyridine-2-carbaldehyde

  • Casno:

    55589-47-4

    3-Methylpyridine-2-carbaldehyde

    Min.Order: 1 Gram

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Specification

The IUPAC name of this chemical is 3-methylpyridine-2-carbaldehyde. With the CAS registry number 55589-47-4, it is also named as 2-Pyridinecarboxaldehyde, 3-methyl-. The product's categories are Pyridine; Pharmacetical; Pyridine Series; Aldehydes. In addition, the formula C7H7NO is and the molecular weight is 121.14. 

The other characteristics of 3-Methylpyridine-2-carbaldehyde can be summarized as: (1)ACD/LogP: 0.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.88; (4)ACD/LogD (pH 7.4): 0.9; (5)ACD/BCF (pH 5.5): 2.72; (6)ACD/BCF (pH 7.4): 2.83; (7)ACD/KOC (pH 5.5): 70.34; (8)ACD/KOC (pH 7.4): 73.32; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.563; (13)Molar Refractivity: 35.92 cm3; (14)Molar Volume: 110.5 cm3; (15)Polarizability: 14.24×10-24 cm3; (16)Surface Tension: 43.5 dyne/cm; (17)Enthalpy of Vaporization: 44.32 kJ/mol; (18)Vapour Pressure: 0.231 mmHg at 25°C; (19)Rotatable Bond Count: 1; (20)Exact Mass: 121.052764; (21)MonoIsotopic Mass: 121.052764; (22)Topological Polar Surface Area: 30; (23)Heavy Atom Count: 9; (24)Complexity: 103.

When you are using this chemical, please be cautious about it as the following:
It is not only harmful if swallowed, but also irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing, gloves and eye/face protection.

People can use the following data to convert to the molecule structure.
1. SMILES:O=Cc1ncccc1C
2. InChI:InChI=1/C7H7NO/c1-6-3-2-4-8-7(6)5-9/h2-5H,1H3 
3. InChIKey:JDYVLWWFVYNMTN-UHFFFAOYAQ