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Home > Boronic Acids > 945226-59-5
945226-59-5 | 2-(4-METHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL)OXAZOLE
CAS No: 945226-59-5 Catalog No: AG005WM3 MDL No:
Product Description
Catalog Number:
AG005WM3
Chemical Name:
2-(4-METHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL)OXAZOLE
CAS Number:
945226-59-5
Molecular Formula:
C16H20BNO3
Molecular Weight:
285.1459
IUPAC Name:
2-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3-oxazole
InChI:
InChI=1S/C16H20BNO3/c1-11-6-7-12(14-18-8-9-19-14)10-13(11)17-20-15(2,3)16(4,5)21-17/h6-10H,1-5H3
InChI Key:
SGGMZIKSMGSCQZ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)c1ncco1
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.154g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.15g/mol
Monoisotopic Mass:
285.154g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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