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25980-22-7

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Basic Information
CAS No.: 25980-22-7
Name: N,N'-Bis(2-propenyl)-2,3-quinoxalinediamine
Molecular Structure:
Molecular Structure of 25980-22-7 (N,N'-Bis(2-propenyl)-2,3-quinoxalinediamine)
Formula: C14H16N4
Molecular Weight: 240.3036
Synonyms: 2,3-Quinoxalinediamine,N,N'-di-2-propenyl- (9CI);Quinoxaline, 2,3-bis(allylamino)- (8CI);2,3-Bis(allylamino)quinoxaline;
Density: 1.171 g/cm3
Boiling Point: 397.1 °C at 760 mmHg
Flash Point: 194 °C
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Specification

The 2,3-Quinoxalinediamine,N2,N3-di-2-propen-1-yl-, with the CAS registry number 25980-22-7, is also known as N,N'-Bis(2-propenyl)-2,3-quinoxalinediamine. This chemical's molecular formula is C14H16N4 and molecular weight is 240.3036. What's more, its systematic name is N,N'-Di(prop-2-en-1-yl)quinoxaline-2,3-diamine.

Physical properties about 2,3-Quinoxalinediamine,N2,N3-di-2-propen-1-yl are: (1)ACD/LogP: 1.86; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.84; (4)ACD/LogD (pH 7.4): 1.86; (5)ACD/BCF (pH 5.5): 14.71; (6)ACD/BCF (pH 7.4): 15.16; (7)ACD/KOC (pH 5.5): 236.44; (8)ACD/KOC (pH 7.4): 243.63; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 32.26 Å2; (13)Index of Refraction: 1.679; (14)Molar Refractivity: 77.47 cm3; (15)Molar Volume: 205.1 cm3; (16)Polarizability: 30.71×10-24cm3; (17)Surface Tension: 53.3 dyne/cm; (18)Density: 1.171 g/cm3; (19)Flash Point: 194 °C; (20)Enthalpy of Vaporization: 64.75 kJ/mol; (21)Boiling Point: 397.1 °C at 760 mmHg; (22)Vapour Pressure: 1.62E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: n1c2ccccc2nc(c1NC\C=C)NC\C=C
(2) InChI: InChI=1/C14H16N4/c1-3-9-15-13-14(16-10-4-2)18-12-8-6-5-7-11(12)17-13/h3-8H,1-2,9-10H2,(H,15,17)(H,16,18)
(3) InChIKey: QTILQMJCFYQOKH-UHFFFAOYAW