Name: Name:4-Methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
Brand: Angene
SKU: AG004XDL
Rating: 90 (10 reviews)

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

CAS No.:

863868-22-8

Catalog Number:

AG004XDL

Molecular Formula:

C14H18BNO2

Molecular Weight:

243.1092

Catalog Number:

AG004XDL

Chemical Name:

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

CAS Number:

863868-22-8

Molecular Formula:

C14H18BNO2

Molecular Weight:

243.1092

MDL Number:

MFCD12407219

IUPAC Name:

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

InChI:

InChI=1S/C14H18BNO2/c1-10-6-7-11(9-16)12(8-10)15-17-13(2,3)14(4,5)18-15/h6-8H,1-5H3

InChI Key:

WJDTUXBXJIUSRQ-UHFFFAOYSA-N

SMILES:

N#Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)C

Complexity:

355

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.143g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.113g/mol

Monoisotopic Mass:

243.143g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: