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Home > Boronic Acids > 1218791-09-3
1218791-09-3 | 1,3,2-Dioxaborolane, 2-(4-fluoro-3-nitrophenyl)-4,4,5,5-tetramethyl-
CAS No: 1218791-09-3 Catalog No: AG0016AZ MDL No:MFCD12546515
Product Description
Catalog Number:
AG0016AZ
Chemical Name:
1,3,2-Dioxaborolane, 2-(4-fluoro-3-nitrophenyl)-4,4,5,5-tetramethyl-
CAS Number:
1218791-09-3
Molecular Formula:
C12H15BFNO4
Molecular Weight:
267.0612
MDL Number:
MFCD12546515
IUPAC Name:
2-(4-fluoro-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H15BFNO4/c1-11(2)12(3,4)19-13(18-11)8-5-6-9(14)10(7-8)15(16)17/h5-7H,1-4H3
InChI Key:
QBMHYMHOXGOPAF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.108g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.063g/mol
Monoisotopic Mass:
267.108g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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