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3-Pyridinecarboxaldehyde,6-(4-morpholinyl)- (173282-60-5)

Identification
Name:3-Pyridinecarboxaldehyde,6-(4-morpholinyl)-
Synonyms:6-(Morpholin-4-yl)pyridine-3-carboxaldehyde;6-Morpholinonicotinaldehyde;
CAS:173282-60-5
Molecular Formula: C10H12N2O2
Molecular Weight: 192.2145
InChI: InChI=1/C10H12N2O2/c13-8-9-1-2-10(11-7-9)12-3-5-14-6-4-12/h1-2,7-8H,3-6H2
Molecular Structure: (C10H12N2O2) 6-(Morpholin-4-yl)pyridine-3-carboxaldehyde;6-Morpholinonicotinaldehyde;
Properties
Melting Point: 86-88ºC
Flash Point: 193.2 ºC
Boiling Point: 395.8 ºC at 760 mmHg
Density:1.219 g/cm3
Refractive index:1.586
Specification:

The 6-(Morpholin-4-yl)pyridine-3-carboxaldehyde with the CAS number 173282-60-5 is also called 3-Pyridinecarboxaldehyde,6-(4-morpholinyl)-. Its molecular formula is C10H12N2O2. This chemical belongs to the following product categories: (1)Aldehydes; (2)Pyridines. It should be stored under Nitrogen.

The properties of the 6-(Morpholin-4-yl)pyridine-3-carboxaldehyde are: (1)ACD/LogP: -0.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.93; (4)ACD/LogD (pH 7.4): -0.11; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 3.01; (8)ACD/KOC (pH 7.4): 20.07; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 42.43 Å2; (13)Index of Refraction: 1.586; (14)Molar Refractivity: 52.9 cm3; (15)Molar Volume: 157.6 cm3; (16)Polarizability: 20.97×10-24cm3; (17)Surface Tension: 52.2 dyne/cm; (18)Enthalpy of Vaporization: 64.6 kJ/mol; (19)Vapour Pressure: 1.79×10-6 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing, gloves and eye/face protection. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc2cnc(N1CCOCC1)cc2
(2)InChI: InChI=1/C10H12N2O2/c13-8-9-1-2-10(11-7-9)12-3-5-14-6-4-12/h1-2,7-8H,3-6H2
(3)InChIKey: VZEANTSDLFVWCK-UHFFFAOYAZ

Flash Point: 193.2 ºC
Storage Temperature: Store under Nitrogen
Safety Data
Hazard Symbols Xi: Irritant