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874290-90-1

Basic Information
CAS No.: 874290-90-1
Name: 4-CYANOPYRIDIN-3-YLBORONIC ACID
Molecular Structure:
Molecular Structure of 874290-90-1 (4-CYANOPYRIDIN-3-YLBORONIC ACID)
Formula: C10H14ClN3O
Molecular Weight: 147.929
Synonyms: Boronicacid, (4-cyano-3-pyridinyl)- (9CI);4-Cyanopyridine-3-boronic acid;
Density: 1.217 g/cm3
Boiling Point: 458.4 °C at 760 mmHg
Flash Point: 231 °C
PSA: 77.14000
LogP: -1.36692
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Specification

The cas register number of N-(6-Chloro-3-pyridazinyl)hexanamide is 868948-14-5. It also can be called as Hexanamide,N-(6-chloro-3-pyridazinyl)- and the Systematic name about this chemical is Hexanamide, N-(6-chloro-3-pyridazinyl)-.

Physical properties about N-(6-Chloro-3-pyridazinyl)hexanamide are: (1)ACD/LogP: 1.46; (2)ACD/LogD (pH 5.5): 1.46; (3)ACD/LogD (pH 7.4): 1.46; (4)#H bond acceptors: 4; (5)#H bond donors: 1; (6)#Freely Rotating Bonds: 4; (7)Polar Surface Area: 54.88Å2; (8)Index of Refraction: 1.556; (9)Molar Refractivity: 60.13 cm3; (10)Molar Volume: 186.9 cm3; (11)Polarizability: 23.83x10-24cm3; (12)Surface Tension: 48.8 dyne/cm; (13)Enthalpy of Vaporization: 71.87 kJ/mol; (14)Vapour Pressure: 1.38E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccc(Cl)nn1)CCCCC
(2)InChI: InChI=1/C10H14ClN3O/c1-2-3-4-5-10(15)12-9-7-6-8(11)13-14-9/h6-7H,2-5H2,1H3,(H,12,14,15)
(3)InChIKey: LPWVJLXWPDWEBU-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C10H14ClN3O/c1-2-3-4-5-10(15)12-9-7-6-8(11)13-14-9/h6-7H,2-5H2,1H3,(H,12,14,15)
(5)Std. InChIKey: LPWVJLXWPDWEBU-UHFFFAOYSA-N