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Home > Boronic Acids > 376584-62-2

376584-62-2

376584-62-2 | 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one

CAS No: 376584-62-2 Catalog No: AG0037XP MDL No:MFCD11040393

Product Description

Catalog Number:
AG0037XP
Chemical Name:
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one
CAS Number:
376584-62-2
Molecular Formula:
C14H18BNO3
Molecular Weight:
259.1086
MDL Number:
MFCD11040393
IUPAC Name:
5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydroisoindol-1-one
InChI:
InChI=1S/C14H18BNO3/c1-13(2)14(3,4)19-15(18-13)10-5-6-11-9(7-10)8-16-12(11)17/h5-7H,8H2,1-4H3,(H,16,17)
InChI Key:
CLACMCLRELMFLJ-UHFFFAOYSA-N
SMILES:
O=C1NCc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C

Properties

Complexity:
380  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.138g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.112g/mol
Monoisotopic Mass:
259.138g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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