CAS No.59237-53-5,Methyl-6-chloro-5-nitronicotinate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	59237-53-5
Name:	Methyl-6-chloro-5-nitronicotinate
Article Data:	20

Formula:	C₇H₅ClN₂O₄
Molecular Weight:	216.581
Synonyms:	6-Chloro-5-nitronicotinicacid methyl ester;Methyl 2-chloro-3-nitropyridine-5-carboxylate;Methyl 6-chloro-5-nitronicotinate;Methyl 6-chloro-5-nitropyridine-3-carboxylate;NSC 405361;
Density:	1.5 g/cm³
Melting Point:	76 °C
Boiling Point:	317.8 °C at 760 mmHg
Flash Point:	146 °C
PSA:	85.01000
LogP:	1.95300

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Specification

The CAS register number of Methyl 6-chloro-5-nitronicotinate is 59237-53-5. It also can be called as 3-Pyridinecarboxylicacid, 6-chloro-5-nitro-, methyl ester and the IUPAC name about this chemical is methyl 6-chloro-5-nitropyridine-3-carboxylate. The molecular formula about this chemical is C₇H₅ClN₂O₄ and the molecular weight is 216.58.

Physical properties about Methyl 6-chloro-5-nitronicotinate are: (1)ACD/LogP: 1.05; (2)#H bond acceptors: 6; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 85.01Å²; (5)Index of Refraction: 1.572; (6)Molar Refractivity: 47.55 cm³; (7)Molar Volume: 144.3 cm³; (8)Polarizability: 18.85x10^-24cm³; (9)Surface Tension: 57.5 dyne/cm; (10)Enthalpy of Vaporization: 55.93 kJ/mol; (11)Boiling Point: 317.8 °C at 760 mmHg; (12)Vapour Pressure: 0.000375 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1cc(cnc1Cl)C(=O)OC
(2)InChI: InChI=1/C7H5ClN2O4/c1-14-7(11)4-2-5(10(12)13)6(8)9-3-4/h2-3H,1H3
(3)InChIKey: BRPREIDVQXJOJH-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C7H5ClN2O4/c1-14-7(11)4-2-5(10(12)13)6(8)9-3-4/h2-3H,1H3
(5)Std. InChIKey: BRPREIDVQXJOJH-UHFFFAOYSA-N