Name: Name:Benzonitrile, 2-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]methyl]-
Brand: Angene
SKU: AG01EHYF
Rating: 90 (10 reviews)

Benzonitrile, 2-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]methyl]-

CAS No.:

2246772-09-6

Catalog Number:

AG01EHYF

Molecular Formula:

C20H22BNO3

Molecular Weight:

335.2046

Catalog Number:

AG01EHYF

Chemical Name:

Benzonitrile, 2-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]methyl]-

CAS Number:

2246772-09-6

Molecular Formula:

C20H22BNO3

Molecular Weight:

335.2046

MDL Number:

MFCD31916442

IUPAC Name:

2-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]methyl]benzonitrile

InChI:

InChI=1S/C20H22BNO3/c1-19(2)20(3,4)25-21(24-19)17-10-7-11-18(12-17)23-14-16-9-6-5-8-15(16)13-22/h5-12H,14H2,1-4H3

InChI Key:

NZECDMMIVDMXGK-UHFFFAOYSA-N

SMILES:

N#Cc1ccccc1COc1cccc(c1)B1OC(C(O1)(C)C)(C)C

Complexity:

496

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

335.169g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

335.21g/mol

Monoisotopic Mass:

335.169g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: