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2-(4,5-dimethoxy-2-nitrophenyl)acetonitrile

Catalog No: FT-0748109

CAS No: 17354-04-0

Chemical Name: 2-(4,5-dimethoxy-2-nitrophenyl)acetonitrile
Molecular Formula: C10H10N2O4
Molecular Weight: 222.2
InChI Key: PKDJSFDIQCAPSY-UHFFFAOYSA-N
InChI: InChI=1S/C10H10N2O4/c1-15-9-5-7(3-4-11)8(12(13)14)6-10(9)16-2/h5-6H,3H2,1-2H3

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

Melting_Point:	110-112ºC
FW:	222.19700
CAS:	17354-04-0
MF:	C10H10N2O4
Flash_Point:	194.8ºC
Product_Name:	2-(4,5-dimethoxy-2-nitrophenyl)acetonitrile
Bolling_Point:	398.5ºC at 760 mmHg
Density:	1.266 g/cm3

Refractive_Index:	1.546
Vapor_Pressure:	1.47E-06mmHg at 25°C
Flash_Point:	194.8ºC
LogP:	2.20128
Bolling_Point:	398.5ºC at 760 mmHg
FW:	222.19700
PSA:	88.07000
Computational_Chemistry:	['1. XlogP :13 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA :881 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :293 ', '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:	110-112ºC
MF:	C10H10N2O4
Exact_Mass:	222.06400
Density:	1.266 g/cm3