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887578-93-0

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Basic Information
CAS No.: 887578-93-0
Name: 4-PYRIDIN-3-YL-BUTYRAMIDINE
Molecular Structure:
Molecular Structure of 887578-93-0 (4-PYRIDIN-3-YL-BUTYRAMIDINE)
Formula: C9H13N3
Molecular Weight: 163.22
Synonyms: 4-PYRIDIN-3-YL-BUTYRAMIDINE;3-Pyridinebutanimidamide
Density: 1.1 g/cm3
Boiling Point: 307 °C at 760 mmHg
Flash Point: 139.5 °C
PSA: 62.76000
LogP: 2.14030
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Specification

The cas register number of 3-Pyridinebutanimidamide is 887578-93-0. The Systematic name about this chemical is 4-(3-pyridyl)butanamidine.

Physical properties about 3-Pyridinebutanimidamide are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1; (4)ACD/KOC (pH 7.4): 1; (5)#H bond acceptors: 3; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 4; (8)Polar Surface Area: 62.76 Å2; (9)Index of Refraction: 1.571; (10)Molar Refractivity: 48.35 cm3; (11)Molar Volume: 147.1 cm3; (12)Polarizability: 19.16x10-24cm3; (13)Surface Tension: 45 dyne/cm; (14)Enthalpy of Vaporization: 54.76 kJ/mol; (15)Vapour Pressure: 0.000743 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(cnc1)CCCC(=N)N
(2)InChI: InChI=1/C9H13N3/c10-9(11)5-1-3-8-4-2-6-12-7-8/h2,4,6-7H,1,3,5H2,(H3,10,11)
(3)InChIKey: UYRFJJJSEKLZRY-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C9H13N3/c10-9(11)5-1-3-8-4-2-6-12-7-8/h2,4,6-7H,1,3,5H2,(H3,10,11)
(5)Std. InChIKey: UYRFJJJSEKLZRY-UHFFFAOYSA-N