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CAS No.: | 31181-89-2 |
---|---|
Name: | 5-CHLORO-2-FORMYLPYRIDINE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C6H4ClNO |
Molecular Weight: | 141.557 |
Synonyms: | Picolinaldehyde,5-chloro- (8CI);5-Chloro-2-pyridinecarboxaldehyde; |
EINECS: | 695-967-4 |
Density: | 1.332 g/cm3 |
Melting Point: | 66-68 °C |
Boiling Point: | 207.907 °C at 760 mmHg |
Flash Point: | 79.54 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36-43 |
Safety: | 26-36/37 |
PSA: | 29.96000 |
LogP: | 1.54750 |
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The CAS register number of 2-Pyridinecarboxaldehyde,5-chloro- is 31181-89-2. It also can be called as 5-Chloro-2-formylpyridine and the IUPAC name about this chemical is 5-chloropyridine-2-carbaldehyde. The molecular formula about this chemical is C6H4ClNO and the molecular weight is 141.56. It belongs to the following product categories which include Pyridine; Boronic Acid; Building Blocks and so on.
Physical properties about 2-Pyridinecarboxaldehyde,5-chloro- are: (1)ACD/LogP: 1.20; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 5; (5)ACD/BCF (pH 7.4): 5; (6)ACD/KOC (pH 5.5): 115; (7)ACD/KOC (pH 7.4): 115; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 29.96Å2; (11)Index of Refraction: 1.593; (12)Molar Refractivity: 35.992 cm3; (13)Molar Volume: 106.274 cm3; (14)Polarizability: 14.268x10-24cm3; (15)Surface Tension: 49.824 dyne/cm; (16)Flash Point: 79.54 °C; (17)Enthalpy of Vaporization: 44.416 kJ/mol; (18)Boiling Point: 207.907 °C at 760 mmHg; (19)Vapour Pressure: 0.22 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=NC=C1Cl)C=O
(2)InChI: InChI=1S/C6H4ClNO/c7-5-1-2-6(4-9)8-3-5/h1-4H
(3)InChIKey: YYLBDBOSXXSZQQ-UHFFFAOYSA-N