Name: Name:5-methoxy-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
Brand: Angene
SKU: AG01BG4N
Rating: 90 (10 reviews)

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

CAS No.:

1116097-04-1

Catalog Number:

AG01BG4N

Molecular Formula:

C14H18BNO3

Molecular Weight:

259.1086

Catalog Number:

AG01BG4N

Chemical Name:

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

CAS Number:

1116097-04-1

Molecular Formula:

C14H18BNO3

Molecular Weight:

259.1086

MDL Number:

MFCD22494890

IUPAC Name:

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

InChI:

InChI=1S/C14H18BNO3/c1-13(2)14(3,4)19-15(18-13)12-7-6-11(17-5)8-10(12)9-16/h6-8H,1-5H3

InChI Key:

RMJHQHSCNOVZLH-UHFFFAOYSA-N

SMILES:

N#Cc1cc(OC)ccc1B1OC(C(O1)(C)C)(C)C

Complexity:

371

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

259.138g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

259.112g/mol

Monoisotopic Mass:

259.138g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: