-
Name
3-Amino-2,6-dichloropyridine-4-carboxylic acid methyl ester
- EINECS
- CAS No. 883107-62-8
- Density 1.506 g/cm3
- Solubility
- Melting Point
- Formula C7H6Cl2N2O2
- Boiling Point 361.5 °C at 760 mmHg
- Molecular Weight 221.043
- Flash Point 172.4 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 3-Amino-2,6-dichloroisonicotinicacid methyl ester;
- PSA 65.21000
- LogP 2.33840
4-Pyridinecarboxylicacid, 3-amino-2,6-dichloro-, methyl ester Specification
This chemical is called 4-Pyridinecarboxylic acid, 3-amino-2,6-dichloro-, methyl ester, and its systematic name is Methyl 3-amino-2,6-dichloropyridine-4-carboxylate. With the molecular formula of C7H6Cl2N2O2, its molecular weight is . The CAS registry number of this chemical is 221.04. Additionally, its product category is Pyridines.
Other characteristics of the 4-Pyridinecarboxylic acid, 3-amino-2,6-dichloro-, methyl ester can be summarised as followings: (1)ACD/LogP: 3.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.34; (4)ACD/LogD (pH 7.4): 3.34; (5)ACD/BCF (pH 5.5): 203.95; (6)ACD/BCF (pH 7.4): 203.95; (7)ACD/KOC (pH 5.5): 1565.92; (8)ACD/KOC (pH 7.4): 1565.92; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 42.43 Å2; (13)Index of Refraction: 1.599; (14)Molar Refractivity: 50.14 cm3; (15)Molar Volume: 146.7 cm3; (16)Polarizability: 19.87×10-24cm3; (17)Surface Tension: 57.3 dyne/cm; (18)Density: 1.506 g/cm3; (19)Flash Point: 172.4 °C; (20)Enthalpy of Vaporization: 60.74 kJ/mol; (21)Boiling Point: 361.5 °C at 760 mmHg; (22)Vapour Pressure: 2.06E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Clc1nc(Cl)cc(C(=O)OC)c1N
2.InChI: InChI=1/C7H6Cl2N2O2/c1-13-7(12)3-2-4(8)11-6(9)5(3)10/h2H,10H2,1H3
3.InChIKey: WJJUPJNQONPAJG-UHFFFAOYAP
Related Products
- 4-Pyridinecarboxylicacid, 1,2-dihydro-1-methyl-2-oxo-, ethyl ester
- 4-Pyridinecarboxylicacid, 1,2-dihydro-2-oxo-, methyl ester
- 4-Pyridinecarboxylicacid, 2-(1-pyrrolidinyl)-
- 4-Pyridinecarboxylicacid, 2-(4-thiomorpholinyl)-, methyl ester
- 4-Pyridinecarboxylicacid, 2-(acetylamino)-5-bromo-
- 4-Pyridinecarboxylicacid, 2,6-dibromo-3,5-difluoro-
- 4-Pyridinecarboxylicacid, 2,6-dichloro-3-hydroxy-
- 4-Pyridinecarboxylicacid, 2-[(methylamino)carbonyl]-, ethyl ester
- 4-Pyridinecarboxylicacid, 2-amino-3,5,6-trifluoro-, ethyl ester
- 4-Pyridinecarboxylicacid, 2-chloro-3-hydroxy-
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