Basic Information | Post buying leads | Suppliers |
Name |
5-Isopropylpyridine-2-carboxaldehyde |
EINECS | N/A |
CAS No. | 137013-14-0 | Density | 1.033 g/cm3 |
PSA | 29.96000 | LogP | 2.01750 |
Solubility | N/A | Melting Point |
N/A |
Formula | C9H11NO | Boiling Point | 252.356 °C at 760 mmHg |
Molecular Weight | 149.19 | Flash Point | 112.988 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Pyridinecarboxaldehyde, 5-(1-methylethyl)- (9CI);2-Formyl-5-isopropylpyridine;5-Isopropylpyridine-2-carboxaldehyde;5-isopropylpicolin Aldehyde;5-isopropylpicolin |
The 5-Isopropylpyridine-2-carboxaldehyde is an organic compound with the formula C9H11NO. The systematic name of this chemical is 5-isopropylpyridine-2-carbaldehyde. With the CAS registry number 137013-14-0, it is also named as 2-Pyridinecarboxaldehyde, 5-(1-methylethyl)- (9CI). The product's categories are Aldehyde; Pyridine.
Physical properties about 5-Isopropylpyridine-2-carboxaldehyde are: (1)ACD/LogP: 2.11; (2)ACD/LogD (pH 5.5): 2.1; (3)ACD/LogD (pH 7.4): 2.112; (4)ACD/BCF (pH 5.5): 23.055; (5)ACD/BCF (pH 7.4): 23.702; (6)ACD/KOC (pH 5.5): 326.311; (7)ACD/KOC (pH 7.4): 335.459; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 29.96 Å2; (11)Index of Refraction: 1.54; (12)Molar Refractivity: 45.282 cm3; (13)Molar Volume: 144.396 cm3; (14)Polarizability: 17.951×10-24cm3; (15)Surface Tension: 39.294 dyne/cm; (16)Density: 1.033 g/cm3; (17)Flash Point: 112.988 °C; (18)Enthalpy of Vaporization: 48.97 kJ/mol; (19)Boiling Point: 252.356 °C at 760 mmHg; (20)Vapour Pressure: 0.019 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)c1ccc(nc1)C=O
(2)InChI: InChI=1/C9H11NO/c1-7(2)8-3-4-9(6-11)10-5-8/h3-7H,1-2H3
(3)InChIKey: ZMIPJSJRIRWJBY-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C9H11NO/c1-7(2)8-3-4-9(6-11)10-5-8/h3-7H,1-2H3
(5)Std. InChIKey: ZMIPJSJRIRWJBY-UHFFFAOYSA-N