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Home > Boronic Acids > 1644499-93-3
1644499-93-3 | dimethyl({[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]imino})-lambda6-sulfanone
CAS No: 1644499-93-3 Catalog No: AG01BZSY MDL No:MFCD30486804
Product Description
Catalog Number:
AG01BZSY
Chemical Name:
dimethyl({[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]imino})-lambda6-sulfanone
CAS Number:
1644499-93-3
Molecular Formula:
C14H22BNO3S
Molecular Weight:
295.2054
MDL Number:
MFCD30486804
IUPAC Name:
dimethyl-oxo-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]imino-λ6-sulfane
InChI:
InChI=1S/C14H22BNO3S/c1-13(2)14(3,4)19-15(18-13)11-7-9-12(10-8-11)16-20(5,6)17/h7-10H,1-6H3
InChI Key:
PPCSEQIXCANFRZ-UHFFFAOYSA-N
SMILES:
CS(=Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)(=O)C
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.141g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.204g/mol
Monoisotopic Mass:
295.141g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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