Methyl 4-chloro-5-methylpicolinate supplier

Name
Methyl 4-chloro-5-methylpicolinate
EINECS
CAS No. 1104455-41-5
Article Data3
CAS DataBase
Density 1.248 g/cm³
Solubility
Melting Point
Formula C₈H₈ClNO₂
Boiling Point 287.703 °C at 760 mmHg
Molecular Weight 185.61
Flash Point 127.799 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Chloro-5-methylpyridine-2-carboxylic acid methyl ester;
PSA 39.19000
LogP 1.83000

Methyl 4-chloro-5-methylpicolinate Specification

The Methyl 4-chloro-5-methylpicolinate, with the CAS registry number 1104455-41-5, is also known as 4-Chloro-5-methylpyridine-2-carboxylic acid methyl ester. This chemical's molecular formula is C₈H₈ClNO₂ and molecular weight is 185.60. What's more, its IUPAC name is Methyl 4-chloro-5-methylpyridine-2-carboxylate.

Physical properties about Methyl 4-chloro-5-methylpicolinate: (1)ACD/LogP: 1.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.47; (4)ACD/LogD (pH 7.4): 1.47; (5)ACD/BCF (pH 5.5): 7.72; (6)ACD/BCF (pH 7.4): 7.72; (7)ACD/KOC (pH 5.5): 150.27; (8)ACD/KOC (pH 7.4): 150.27; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 39.19 Å²; (13)Index of Refraction: 1.528; (14)Molar Refractivity: 45.837 cm³; (15)Molar Volume: 148.776 cm³; (16)Polarizability: 18.171×10^-24cm³; (17)Surface Tension: 42.464 dyne/cm; (18)Density: 1.248 g/cm³; (19)Flash Point: 127.799 °C; (20)Enthalpy of Vaporization: 52.689 kJ/mol; (21)Boiling Point: 287.703 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1) SMILES: Cc1cnc(cc1Cl)C(=O)OC;
(2) InChI: InChI=1S/C8H8ClNO2/c1-5-4-10-7(3-6(5)9)8(11)12-2/h3-4H,1-2H3;
(3) InChIKey: KSYLPGBLKZFIQN-UHFFFAOYSA-N;

Product Name

Methyl 4-chloro-5-methylpicolinate

Methyl 4-chloro-5-methylpicolinate Specification

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