Home Other Building Blocks 3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutan-1-one

3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutan-1-one

CAS No.:
1609119-82-5
Catalog Number:
AG01EL1I
Molecular Formula:
C16H21BO3
Molecular Weight:
272.1471
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Product Description
Catalog Number:
AG01EL1I
Chemical Name:
3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutan-1-one
CAS Number:
1609119-82-5
Molecular Formula:
C16H21BO3
Molecular Weight:
272.1471
MDL Number:
MFCD31457248
IUPAC Name:
3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutan-1-one
InChI:
InChI=1S/C16H21BO3/c1-15(2)16(3,4)20-17(19-15)13-7-5-11(6-8-13)12-9-14(18)10-12/h5-8,12H,9-10H2,1-4H3
InChI Key:
GDQNMLOVZSWLIZ-UHFFFAOYSA-N
SMILES:
O=C1CC(C1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
373  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.158g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.151g/mol
Monoisotopic Mass:
272.158g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties