Name: Name:Benzonitrile, 5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoroMethyl)-
Brand: Angene
SKU: AG009C9S
Rating: 90 (10 reviews)

Benzonitrile, 5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoroMethyl)-

CAS No.:

1220219-14-6

Catalog Number:

AG009C9S

Molecular Formula:

C14H15BF3NO2

Molecular Weight:

297.0806

Catalog Number:

AG009C9S

Chemical Name:

Benzonitrile, 5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoroMethyl)-

CAS Number:

1220219-14-6

Molecular Formula:

C14H15BF3NO2

Molecular Weight:

297.0806

MDL Number:

MFCD18383806

IUPAC Name:

5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzonitrile

InChI:

InChI=1S/C14H15BF3NO2/c1-12(2)13(3,4)21-15(20-12)10-5-6-11(14(16,17)18)9(7-10)8-19/h5-7H,1-4H3

InChI Key:

IUORZQUIVDCXJO-UHFFFAOYSA-N

SMILES:

N#Cc1cc(ccc1C(F)(F)F)B1OC(C(O1)(C)C)(C)C

Complexity:

439

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

297.115g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

297.084g/mol

Monoisotopic Mass:

297.115g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: