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Name	6-Bromo-2H-isoquinolin-1-one	EINECS	N/A
CAS No.	82827-09-6	Density	1.62 g/cm³
PSA	32.86000	LogP	2.29060
Solubility	N/A	Melting Point	N/A
Formula	C9H6 Br N O	Boiling Point	442.634 °C at 760 mmHg
Molecular Weight	224.057	Flash Point	221.498 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	6-Bromo-2H-isoquinolin-1-one;6-Bromoisoquinolin-1-one	Article Data	19

6-Bromo-2H-isoquinolin-1-one Chemical Properties

Empirical Formula of 6-Bromo-2H-isoquinolin-1-one (CAS NO.82827-09-6): C₉H₆BrNO
Molecular Weight: 224.054
Nominal Mass: 223 Da
Average Mass: 224.054 Da
Monoisotopic Mass: 222.963269 Da
Index of Refraction: 1.63
Molar Refractivity: 49.2 cm³
Molar Volume: 138.272 cm³
Surface Tension: 48.348 dyne/cm
Density: 1.62 g/cm³
Flash Point: 221.498 °C
Enthalpy of Vaporization: 70.014 kJ/mol
Boiling Point: 442.634 °C at 760 mmHg
Structure of 6-Bromo-2H-isoquinolin-1-one (CAS NO.82827-09-6):

Systematic Name: 6-Bromoisoquinolin-1(2H)-one
SMILES: Brc2ccc1c(\C=C/NC1=O)c2
InChI: InChI=1/C9H6BrNO/c10-7-1-2-8-6(5-7)3-4-11-9(8)12/h1-5H,(H,11,12)
InChIKey: ZDYXSEQHOVSTPA-UHFFFAOYAK
Std. InChI: InChI=1S/C9H6BrNO/c10-7-1-2-8-6(5-7)3-4-11-9(8)12/h1-5H,(H,11,12)
Std. InChIKey: ZDYXSEQHOVSTPA-UHFFFAOYSA-N

6-Bromo-2H-isoquinolin-1-one Specification

6-Bromo-2H-isoquinolin-1-one (CAS NO.82827-09-6) also can be called 6-Bromoisoquinolin-1(2H)-one ; and 1(2H)-Isoquinolinone, 6-bromo- .

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