3-Pyridinecarboxylic acid, 2-amino-6-chloro- supplier

Name
2-Amino-5-chloropyridine-3-carboxylic acid
EINECS
CAS No. 58584-92-2
Article Data23
CAS DataBase
Density 1.577 g/cm³
Solubility
Melting Point 195-197 °C(dec)
Formula C₆H₅ClN₂O₂
Boiling Point 383.321 °C at 760 mmHg
Molecular Weight 172.571
Flash Point 185.626 °C
Transport Information
Appearance
Safety 26
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Amino-6-chloropyridine-3-carboxylic acid;2-Amino-6-chloronicotinic acid;Acide 2-amino-6-chloronicotinique;
PSA 76.21000
LogP 1.59660

3-Pyridinecarboxylic acid, 2-amino-6-chloro- Specification

The 3-Pyridinecarboxylic acid, 2-amino-6-chloro-, with the CAS registry number 58584-92-2, is also known as Acide 2-amino-6-chloronicotinique. This chemical's molecular formula is C₆H₅ClN₂O₂ and molecular weight is 172.57. What's more, its systematic name is 2-amino-6-chloropyridine-3-carboxylic acid.

Physical properties of 3-Pyridinecarboxylic acid, 2-amino-6-chloro- are: (1)ACD/LogP: 1.84; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 3; (6) ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 76.21 Å²; (11)Index of Refraction: 1.66; (12)Molar Refractivity: 40.405 cm³; (13)Molar Volume: 109.418 cm³; (14)Polarizability: 16.018×10^-24cm³; (15)Surface Tension: 78.078 dyne/cm; (16)Density: 1.577 g/cm³; (17)Flash Point: 185.626 °C; (18)Enthalpy of Vaporization: 66.648 kJ/mol; (19)Boiling Point: 383.321 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1ccc(Cl)nc1N
(2)InChI: InChI=1S/C6H5ClN2O2/c7-4-2-1-3(6(10)11)5(8)9-4/h1-2H,(H2,8,9)(H,10,11)
(3)InChIKey: INERBKPRIWEQRQ-UHFFFAOYSA-N

Product Name

2-Amino-5-chloropyridine-3-carboxylic acid

3-Pyridinecarboxylic acid, 2-amino-6-chloro- Specification

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