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166398-34-1

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Basic Information
CAS No.: 166398-34-1
Name: 1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile
Article Data: 7
Molecular Structure:
Molecular Structure of 166398-34-1 (1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile)
Formula: C10H10N2
Molecular Weight: 158.203
Synonyms: 1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile;
EINECS: -0
Density: 1.148 g/cm3
Boiling Point: 301.519 °C at 760 mmHg
Flash Point: 136.154 °C
PSA: 35.82000
LogP: 1.53278
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Chemistry

Molecular Structure of 1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile (CAS No.166398-34-1):
 
Molecular Formula: C10H10N2 
Molecular Weight: 158.1998
CAS No: 166398-34-1
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 0
Polar Surface Area: 35.82 Å2
Index of Refraction: 1.595
Molar Refractivity: 46.81 cm3
Molar Volume: 137.754 cm3
Surface Tension: 51.17 dyne/cm
Density: 1.148 g/cm3
Flash Point: 136.154 °C
Enthalpy of Vaporization: 54.167 kJ/mol
Boiling Point: 301.519 °C at 760 mmHg
Vapour Pressure: 0.001 mmHg at 25°C
InChI: InChI=1/C10H10N2/c11-6-8-1-2-10-7-12-4-3-9(10)5-8/h1-2,5,12H,3-4,7H2
InChIKey: RKWNQODBLXZUES-UHFFFAOYAE
Std. InChI: InChI=1S/C10H10N2/c11-6-8-1-2-10-7-12-4-3-9(10)5-8/h1-2,5,12H,3-4,7H2
Std. InChIKey: RKWNQODBLXZUES-UHFFFAOYSA-N
IUPAC Name: 1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile

Specification

   1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile (CAS No.166398-34-1), its synonym is 6-Isoquinolinecarbonitrile, 1,2,3,4-tetrahydro- .