Systematic Name: 1-Chloroisoquinolin-5-amine
Synonyms of 5-Amino-1-chloroisoquinoline (CAS NO.374554-54-8): 5-Isoquinolinamine,1-chloro-
CAS NO: 374554-54-8
Molecular Formula: C9H7ClN2
Molecular Weight: 178.62
Molecular Structure:
H bond acceptors: 2
H bond donors: 2
Freely Rotating Bonds: 1
Polar Surface Area: 16.13 Å2
Index of Refraction: 1.712
Molar Refractivity: 51.31 cm3
Molar Volume: 131 cm3
Surface Tension: 61.5 dyne/cm
Density: 1.363 g/cm3
Flash Point: 179.1 °C
Enthalpy of Vaporization: 61.97 kJ/mol
Boiling Point: 372.6 °C at 760 mmHg
Vapour Pressure: 9.52E-06 mmHg at 25°C
SMILES: Clc2nccc1c(cccc12)N
InChI: InChI=1/C9H7ClN2/c10-9-7-2-1-3-8(11)6(7)4-5-12-9/h1-5H,11H2
InChIKey: DDELEGMETMZLAF-UHFFFAOYAC
Std. InChI: InChI=1S/C9H7ClN2/c10-9-7-2-1-3-8(11)6(7)4-5-12-9/h1-5H,11H2
Std. InChIKey: DDELEGMETMZLAF-UHFFFAOYSA-N
Product Categories of 5-Amino-1-chloroisoquinoline (CAS NO.374554-54-8): ISOQUINOLINE;blocks;Heterocycles;Quinolines;Quinoline&Isoquinolin
Hazard Codes: Xi
Hazard Note: Irritant
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