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Home > Boronic Acids > 880157-10-8
880157-10-8 | benzyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
CAS No: 880157-10-8 Catalog No: AG00H40S MDL No:MFCD06795666
Product Description
Catalog Number:
AG00H40S
Chemical Name:
benzyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
CAS Number:
880157-10-8
Molecular Formula:
C20H23BO4
Molecular Weight:
338.2052
MDL Number:
MFCD06795666
IUPAC Name:
benzyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
InChI:
InChI=1S/C20H23BO4/c1-19(2)20(3,4)25-21(24-19)17-12-8-11-16(13-17)18(22)23-14-15-9-6-5-7-10-15/h5-13H,14H2,1-4H3
InChI Key:
NFOUTNGHWQTMQA-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)B1OC(C(O1)(C)C)(C)C)OCc1ccccc1
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.169g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.21g/mol
Monoisotopic Mass:
338.169g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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