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Methyl 2-pyridylacetate

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Name

Methyl 2-pyridylacetate

EINECS 216-759-8
CAS No. 1658-42-0 Density 1.116 g/cm3
PSA 39.19000 LogP 0.79710
Solubility N/A Melting Point N/A
Formula C8H9NO2 Boiling Point 302.352 °C at 760 mmHg
Molecular Weight 151.165 Flash Point 83.655 °C
Transport Information N/A Appearance Clear yellow liquid
Safety 26-37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 1658-42-0 (METHYL 2-PYRIDYLACETATE) Hazard Symbols IrritantXi
Synonyms

2-Pyridylaceticacid methyl ester;2-[(Methoxycarbonyl)methyl]pyridine;Methyl2-(2-pyridyl)acetate;Methyl 2-pyridineacetate;Methyl 2-pyridinylacetate;Methyl 2-pyridylacetate;NSC 72093;Pyridin-2-ylacetic acid methyl ester;methyl 2-pyridyl acetate;

Article Data 27

Methyl 2-pyridylacetate Specification

This chemical is called Methyl 2-pyridylacetate, and its CAS registry number is 1658-42-0. With the molecular formula of C8H9NO2, its molecular weight is 151.16. Additionally, its product categories are Heterocyclic Compounds; Pyridine; C7 and C8; Heterocyclic Building Blocks.

Other characteristics of the Methyl 2-pyridylacetate can be summarised as followings: (1)ACD/LogP: 0.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.44; (4)ACD/LogD (pH 7.4): 0.47; (5)ACD/BCF (pH 5.5): 1.26; (6)ACD/BCF (pH 7.4): 1.35; (7)ACD/KOC (pH 5.5): 40.26; (8)ACD/KOC (pH 7.4): 43.09; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 39.19 Å2; (13)Index of Refraction: 1.506; (14)Molar Refractivity: 40.3 cm3; (15)Molar Volume: 135.4 cm3; (16)Polarizability: 15.97×10-24cm3; (17)Surface Tension: 40.8 dyne/cm; (18)Density: 1.115 g/cm3; (19)Flash Point: 83.7 °C; (20)Enthalpy of Vaporization: 54.26 kJ/mol; (21)Boiling Point: 302.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000996 mmHg at 25°C.

Uses of this chemical: The hydroxyimino-[2]pyridyl-acetic acid methyl ester could be obtained by the reactant of Methyl 2-pyridylacetate. This reaction needs the reagents of NaNO2, aqueous H2SO4.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C(OC)Cc1ncccc1
2.InChI: InChI=1/C8H9NO2/c1-11-8(10)6-7-4-2-3-5-9-7/h2-5H,6H2,1H3
3.InChIKey: ORAKNQSHWMHCEY-UHFFFAOYAV

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