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Pyridine,2-methoxy-5-methyl- (13472-56-5)

Identification
Name:Pyridine,2-methoxy-5-methyl-
Synonyms:3-Picoline,6-methoxy- (7CI,8CI);2-Methoxy-5-methylpyridine;
CAS:13472-56-5
Molecular Formula: C7H9NO
Molecular Weight: 123.15246
InChI: InChI=1/C7H9NO/c1-6-3-4-7(9-2)5-8-6/h3-5H,1-2H3
Molecular Structure: (C7H9NO) 3-Picoline,6-methoxy- (7CI,8CI);2-Methoxy-5-methylpyridine;
Properties
Flash Point: 61.1°C
Boiling Point: 173.7°Cat760mmHg
Density:1.001g/cm3
Refractive index:1.495
Specification:

The Pyridine,2-methoxy-5-methyl-, with its CAS registry number 13472-56-5, has the IUPAC name of 2-methoxy-5-methylpyridine. This is a kind of colorless liquid, and its product categories are including Pyridine.

The characteristics of Pyridine,2-methoxy-5-methyl- are as follows: (1)ACD/LogP: 1.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.78; (4)ACD/LogD (pH 7.4): 1.78; (5)ACD/BCF (pH 5.5): 13.15; (6)ACD/BCF (pH 7.4): 13.35; (7)ACD/KOC (pH 5.5): 219.11; (8)ACD/KOC (pH 7.4): 222.45; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 22.12; (13)Index of Refraction: 1.494; (14)Molar Refractivity: 35.84 cm3; (15)Molar Volume: 122.9 cm3; (16)Polarizability: 14.21×10-24 cm3; (17)Surface Tension: 33.4 dyne/cm; (18)Density: 1.001 g/cm3; (19)Flash Point: 61.1 °C; (20)Enthalpy of Vaporization: 39.32 kJ/mol; (21)Boiling Point: 173.7 °C at 760 mmHg; (22)Vapour Pressure: 1.67 mmHg at 25°C; (23)Exact Mass: 123.068414; (24)MonoIsotopic Mass: 123.068414; (25)Topological Polar Surface Area: 22.1; (26)Heavy Atom Count: 9; (27)Complexity: 85.

When you are dealing with this chemical, you should be more careful. This is irritating to eyes, respiratory system and skin and may then cause damage to health. And this is dangerous if by inhalation, in contact with skin and if swallowed. Therefore, you should wear suitable protective clothing and if in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

In addition, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: CC1=CN=C(C=C1)OC
(2)InChI: InChI=1S/C7H9NO/c1-6-3-4-7(9-2)8-5-6/h3-5H,1-2H3
(3)InChIKey: NFQGQMBFMIIIOR-UHFFFAOYSA-N

Flash Point: 61.1°C
Safety Data