6-BROMO-3-CYANO-4-METHYLCOUMARIN

Catalog No: FT-0640379

CAS No: 56394-22-0

Chemical Name: 6-BROMO-3-CYANO-4-METHYLCOUMARIN
Molecular Formula: C11H6BrNO2
Molecular Weight: 264.07 g/mol
InChI Key: NPCFOYALAZMRDI-UHFFFAOYSA-N
InChI: InChI=1S/C11H6BrNO2/c1-6-8-4-7(12)2-3-10(8)15-11(14)9(6)5-13/h2-4H,1H3

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Product_Name:	6-Bromo-3-cyano-4-methylcoumarin
Flash_Point:	197.8ºC
Melting_Point:	186-190 °C(lit.)
FW:	264.07500
Density:	1.69g/cm3
CAS:	56394-22-0
Bolling_Point:	403.4ºC at 760 mmHg
MF:	C11H6BrNO2

Molecular_Structure:	['1 . Molar refractive index 5682 ', '2 . Molar volume 1562 ', '3 . Parachor （902K）4387 ', '4 . Surface tension 621 ', '5 . Polarizability 2252 ', '6 . Dielectric constant 未确定']
LogP:	2.73558
Flash_Point:	197.8ºC
Refractive_Index:	1.647
FW:	264.07500
Density:	1.69g/cm3
Bolling_Point:	403.4ºC at 760 mmHg
Computational_Chemistry:	['1. XlogP :24 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 501 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :379 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	186-190 °C(lit.)
PSA:	54.00000
MF:	C11H6BrNO2
More_Info:	['1 . Appearance Solid ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）186-190 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 <P style="TEXT-ALIGN: left; TEXT-INDENT: -18pt; MARGIN: 0cm 0cm 0pt 36pt; mso']
Exact_Mass:	262.95800

Personal_Protective_Equipment:	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
RIDADR:	NONH for all modes of transport
HS_Code:	2932209090
WGK_Germany:	3