Molecule structure of 8-Bromoisoquinoline (CAS NO.63927-22-0):
IUPAC Name: 8-Bromoisoquinoline
Molecular Formula: C9H6BrN
Molecular Weight: 208.05 g/mol
Melting Point: 80.5 °C
Density: 1.564 g/cm3
Flash Point: 142.7 °C
Boiling Point: 312.3 °C at 760 mmHg
Index of Refraction: 1.674 Molar
Refractivity: 49.877 cm3
Molar Volume: 132.958 cm3
Polarizability: 19.773×10-24 cm3
Surface Tension: 51.254 dyne/cm
XLogP3-AA: 2.8
H-Bond Acceptor: 1
Exact Mass: 206.968362
MonoIsotopic Mass: 206.968362
Topological Polar Surface Area: 12.9
Heavy Atom Count: 11
Complexity: 138
Canonical SMILES: C1=CC2=C(C=NC=C2)C(=C1)Br
InChI: InChI=1S/C9H6BrN/c10-9-3-1-2-7-4-5-11-6-8(7)9/h1-6H
InChIKey: DPRIHFQFWWCIGY-UHFFFAOYSA-N
Product Categories of 8-Bromoisoquinoline (CAS NO.63927-22-0): blocks; Bromides; Heterocycles; Quinolines; Quinoline series; Heterocyclic Series; Halides; Quinolines, Isoquinolines & Quinoxalines; Quinoline&Isoquinoline; Isoquinoline Derivertives; Building Blocks; Isoquinoline; Quinolines, Isoquinolines & Quinoxalines
Hazard Codes: Xi, Xn
Risk Statements: 36/37/38-20/21/22
R36/37/38:Irritating to eyes, respiratory system and skin.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
Hazard Note: Irritant
8-Bromoisoquinoline (CAS NO.63927-22-0) is also named as isoquinoline, 8-bromo- ; 8-Bromo-isoquinoline ; 8-Bromoisoquinoline 95% .
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