3-Pyridinecarboxaldehyde,2-chloro-5-methyl- supplier

Name
2-CHLORO-5-METHYLPYRIDINE-3-CARBALDEHYDE
EINECS 213-077-2
CAS No. 92444-99-0
Article Data1
CAS DataBase
Density 1.27 g/cm³
Solubility
Melting Point
Formula C₇H₆ClNO
Boiling Point 265.511 °C at 760 mmHg
Molecular Weight 155.584
Flash Point 114.377 °C
Transport Information
Appearance
Safety 26
Risk Codes 22-36
Molecular Structure
Hazard Symbols Xn
Synonyms 2-Chloro-5-methylnicotinaldehyde;2-Chloro-5-methylpyridine-3-carbaldehyde;2-Chloro-5-methylpyridine-3-carboxaldehyde;
PSA 29.96000
LogP 1.85590

3-Pyridinecarboxaldehyde,2-chloro-5-methyl- Specification

The 3-Pyridinecarboxaldehyde, 2-chloro-5-methyl-, with the CAS registry number 92444-99-0, is also known as 2-Chloro-5-methylnicotinaldehyde. This chemical's molecular formula is C₇H₆ClNO and molecular weight is 155.58. What's more, its systematic name is 2-Chloro-5-methylpyridine-3-carbaldehyde.

Physical properties about 3-Pyridinecarboxaldehyde, 2-chloro-5-methyl- are: (1)ACD/LogP: 1.53; (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): 7; (6)ACD/BCF (pH 7.4): 7; (7)ACD/KOC (pH 5.5): 133; (8)ACD/KOC (pH 7.4): 133; (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: 1.581; (14)Molar Refractivity: 40.817 cm³; (15)Molar Volume: 122.549 cm³; (16)Polarizability: 16.181×10^-24 cm³; (17)Surface Tension: 46.486 dyne/cm; (18)Density: 1.27 g/cm³; (19)Flash Point: 114.377 °C; (20)Enthalpy of Vaporization: 50.344 kJ/mol; (21)Boiling Point: 265.511 °C at 760 mmHg; (22)Vapour Pressure: 0.009 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=Cc1cc(cnc1Cl)C
(2) InChI: InChI=1/C7H6ClNO/c1-5-2-6(4-10)7(8)9-3-5/h2-4H,1H3
(3) InChIKey: IZDJJYRXECMSLX-UHFFFAOYAL

Product Name

2-CHLORO-5-METHYLPYRIDINE-3-CARBALDEHYDE

3-Pyridinecarboxaldehyde,2-chloro-5-methyl- Specification

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