3-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carboxylic acid

Catalog No: FT-0625378

CAS No: 3919-76-4

Molecular Formula: 272.08
Formula Weight: C11H7Cl2NO3
Inchl Key: WQXUUMUOERZZAE-UHFFFAOYSA-N
Inchl: InChI=1S/C11H7Cl2NO3/c1-5-8(11(15)16)10(14-17-5)9-6(12)3-2-4-7(9)13/h2-4H,1H3,(H,15,16)

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Product_Name:	3-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carboxylic acid
Bolling_Point:	383.6±37.0 °C at 760 mmHg
Density:	1.5±0.1 g/cm3
MF:	C11H7Cl2NO3
CAS:	3919-76-4
Melting_Point:	221 °C
Flash_Point:	185.8±26.5 °C
FW:	272.084

MF:	C11H7Cl2NO3
Bolling_Point:	383.6±37.0 °C at 760 mmHg
Exact_Mass:	270.980286
Melting_Point:	221 °C
PSA:	63.33000
Flash_Point:	185.8±26.5 °C
Refractive_Index:	1.600
Density:	1.5±0.1 g/cm3
Computational_Chemistry:	['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 633 ', '7. Heavy Atom Count :17 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :292 ', '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']
FW:	272.084
LogP:	2.13
Vapor_Pressure:	0.0±0.9 mmHg at 25°C

Risk_Statements(EU):	R36/37/38
Hazard_Codes:	Xi:Irritant;
Safety_Statements:	S22-S36/37-S36/37/39-S26
HS_Code:	2934999090
RIDADR:	NONH for all modes of transport