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Methyl 4-chloro-2-pyridinecarboxylate hydrochloride

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Name

Methyl 4-chloro-2-pyridinecarboxylate hydrochloride

EINECS N/A
CAS No. 176977-85-8 Density 1.294 g/cm3
PSA 39.19000 LogP 2.32360
Solubility N/A Melting Point 136-138 °C
Formula C7H7Cl2NO2 Boiling Point 298 °C at 760 mmHg
Molecular Weight 208.044 Flash Point 134 °C
Transport Information N/A Appearance Light Yellow Solid
Safety 26 Risk Codes  Xi:;
Molecular Structure Molecular Structure of 176977-85-8 (Methyl 4-chloro-2-pyridinecarboxylate hydrochloride) Hazard Symbols IrritantXi
Synonyms

methyl 4-chloropyridine-2-carboxylate;4-CHLORO-PYRIDINE-2-CARBOXYLIC ACID METHYL ESTER HYDROCHLORIDE;Methyl4-chloropyridine-2-carboxylatehydrochloride;4-Chloropyridine-2-carboxylic acid methyl ester hydrochloride;Methyl 4-chloropyridine-2-carboxylate hydrodrochloride;Methyl 4-chloropyridine-2-carboxylate hydrochloride;

 

Methyl 4-chloro-2-pyridinecarboxylate hydrochloride Specification

The cas register number of Methyl 4-chloro-2-pyridinecarboxylate hydrochloride is 176977-85-8. It also can be called as 4-Chloro-2-pyridinecarboxylic acid methyl ester hydrochloride and the IUPAC Name about this chemical is methyl 4-chloropyridine-2-carboxylate hydrochloride. It belongs to the following product categories, such as blocks, Carboxes, Pyridines, Pyridine, API intermediates, Aromatics Compounds, Aromatics, Bases & Related Reagents, Nucleotides and so on.

Physical properties about Methyl 4-chloro-2-pyridinecarboxylate hydrochloride are: (1)ACD/LogP: 1.01; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 3; (5)ACD/BCF (pH 7.4): 3; (6)ACD/KOC (pH 5.5): 84; (7)ACD/KOC (pH 7.4): 84; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 39.19Å2; (11)Enthalpy of Vaporization: 54.87 kJ/mol; (12)Vapour Pressure: 0.000978 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC(=O)C1=NC=CC(=C1)Cl.Cl
(2)InChI: InChI=1S/C7H6ClNO2.ClH/c1-11-7(10)6-4-5(8)2-3-9-6;/h2-4H,1H3;1H
(3)InChIKey: PAGFSBPYVNFHAS-UHFFFAOYSA-N 

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