CAS No.138084-66-9,4-Pyridinol,5-amino-2-chloro-(9CI) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	138084-66-9
Name:	4-Pyridinol,5-amino-2-chloro-(9CI)

Formula:	C₅H₅ClN₂O
Molecular Weight:	144.559
Synonyms:	4-Pyridinol, 5-amino-2-chloro-;
Density:	1.517 g/cm³
Boiling Point:	517.347 °C at 760 mmHg
Flash Point:	266.682 °C
PSA:	59.14000
LogP:	1.60400

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Specification

The 5-Amino-2-chloro-pyridin-4-ol, with the CAS registry number 138084-66-9, is also known as 4-Pyridinol, 5-amino-2-chloro-. It belongs to the product category of Pyridine. This chemical's molecular formula is C₅H₅ClN₂O and molecular weight is 144.559. What's more, its IUPAC name is 5-Amino-2-chloro-1H-pyridin-4-one.

Physical properties about 5-Amino-2-chloro-pyridin-4-ol are: (1)ACD/LogP: 0.42; (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): 8.634; (6)ACD/KOC (pH 7.4): 8.008; (7)#H bond acceptors: 3; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 59.14 Å²; (11)Index of Refraction: 1.664; (12)Molar Refractivity: 35.357 cm³; (13)Molar Volume: 95.318 cm³; (14)Polarizability: 14.017×10^-24 cm³; (15)Surface Tension: 72.5 dyne/cm; (16)Density: 1.517 g/cm³; (17)Flash Point: 266.682 °C; (18)Enthalpy of Vaporization: 81.942 kJ/mol; (19)Boiling Point: 517.347 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1c(c(cnc1Cl)N)O
(2) InChI: InChI=1/C5H5ClN2O/c6-5-1-4(9)3(7)2-8-5/h1-2H,7H2,(H,8,9)
(3) InChIKey: ZQVVXGWZNUNTFS-UHFFFAOYAI