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CAS No.: | 206181-90-0 |
---|---|
Name: | 3-Chloropyridine-2-carboxaldehyde |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C6H4ClNO |
Molecular Weight: | 141.557 |
Synonyms: | 3-Chloropyridine-2-carboxaldehyde;3-chloropicolinaldehyde; |
Density: | 1.332 g/cm3 |
Boiling Point: | 201.556 °C at 760 mmHg |
Flash Point: | 75.699 °C |
Transport Information: | UN 1198 3/PG 3 |
PSA: | 29.96000 |
LogP: | 1.54750 |
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The CAS register number of 3-Chloropyridine-2-carboxaldehyde is 206181-90-0. It also can be called as 3-chloropicolinaldehyde and the Systematic name about this chemical is 3-chloropyridine-2-carbaldehyde. The molecular formula about this chemical is C6H4ClNO and the molecular weight is 141.55506. It belongs to the following product categories which include Pyridine; Building Blocks and so on.
Physical properties about 3-Chloropyridine-2-carboxaldehyde are: (1)ACD/LogP: 1.32; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 7; (5)ACD/BCF (pH 7.4): 7; (6)ACD/KOC (pH 5.5): 134; (7)ACD/KOC (pH 7.4): 134; (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)Density: 1.332 g/cm3; (17)Flash Point: 75.699 °C; (18)Enthalpy of Vaporization: 43.777 kJ/mol; (19)Boiling Point: 201.556 °C at 760 mmHg; (20)Vapour Pressure: 0.306 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cccnc1C=O
(2)InChI: InChI=1/C6H4ClNO/c7-5-2-1-3-8-6(5)4-9/h1-4H
(3)InChIKey: QXNVCYJXFQPEKQ-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C6H4ClNO/c7-5-2-1-3-8-6(5)4-9/h1-4H
(5)Std. InChIKey: QXNVCYJXFQPEKQ-UHFFFAOYSA-N