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3274-37-1

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Basic Information
CAS No.: 3274-37-1
Name: 1,4-DIHYDRO-2,4,6-TRIMETHYL-3,5-PYRIDINEDICARBONITRILE
Article Data: 9
Molecular Structure:
Molecular Structure of 3274-37-1 (1,4-DIHYDRO-2,4,6-TRIMETHYL-3,5-PYRIDINEDICARBONITRILE)
Formula: C10H11N3
Molecular Weight: 173.217
Synonyms: 2,4,6-Trimethyl-1,4-dihydropyridine-3,5-dicarbonitrile;1,4-Dihydro-2,4,6-trimethyl-3,5-pyridinedicarbonitrile;2,4,6-Trimethyl-1,4-dihydro-3,5-pyridinedicarbonitrile;
Density: 1.1 g/cm3
Boiling Point: 311.5 °C at 760 mmHg
Flash Point: 142.2 °C
PSA: 59.61000
LogP: 2.14966
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Specification

The 3,5-Pyridinedicarbonitrile,1,4-dihydro-2,4,6-trimethyl-, with the CAS registry number 3274-37-1, is also known as 1,4-Dihydro-2,4,6-trimethyl-3,5-pyridinedicarbonitrile. This chemical's molecular formula is C10H11N3 and molecular weight is 173.21. What's more, its systematic name is 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarbonitrile.

Physical properties of 3,5-Pyridinedicarbonitrile,1,4-dihydro-2,4,6-trimethyl- are: (1)ACD/LogP: 0.68; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.68; (4)ACD/LogD (pH 7.4): 0.68; (5)ACD/BCF (pH 5.5): 1.92; (6)ACD/BCF (pH 7.4): 1.92; (7)ACD/KOC (pH 5.5): 55.57; (8)ACD/KOC (pH 7.4): 55.58; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 50.82 Å2; (13)Index of Refraction: 1.531; (14)Molar Refractivity: 48.72 cm3; (15)Molar Volume: 157.3 cm3; (16)Polarizability: 19.31×10-24cm3; (17)Surface Tension: 44.3 dyne/cm; (18)Density: 1.1 g/cm3; (19)Flash Point: 142.2 °C; (20)Enthalpy of Vaporization: 55.25 kJ/mol; (21)Boiling Point: 311.5 °C at 760 mmHg; (22)Vapour Pressure: 0.00056 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#C\C1=C(\N/C(=C(/C#N)C1C)C)C
(2)InChI: InChI=1S/C10H11N3/c1-6-9(4-11)7(2)13-8(3)10(6)5-12/h6,13H,1-3H3
(3)InChIKey: VGTGFBRSPOIYFC-UHFFFAOYSA-N