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Home > Boronic Acids > 1873272-97-9
1873272-97-9 | 3-[2-(tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]benzonitrile
CAS No: 1873272-97-9 Catalog No: AG01DSMH MDL No:
Product Description
Catalog Number:
AG01DSMH
Chemical Name:
3-[2-(tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]benzonitrile
CAS Number:
1873272-97-9
Molecular Formula:
C15H18BNO2
Molecular Weight:
255.1199
IUPAC Name:
3-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]benzonitrile
InChI:
InChI=1S/C15H18BNO2/c1-14(2)15(3,4)19-16(18-14)9-8-12-6-5-7-13(10-12)11-17/h5-10H,1-4H3
InChI Key:
JMNVNIDLBAPUEI-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)C=CB1OC(C(O1)(C)C)(C)C
Properties
Complexity:
392
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.143g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.124g/mol
Monoisotopic Mass:
255.143g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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