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Home > Boronic Acids > 754226-39-6
754226-39-6 | 2-(3,4-DIFLUOROPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
CAS No: 754226-39-6 Catalog No: AG005BIT MDL No:MFCD12405348
Product Description
Catalog Number:
AG005BIT
Chemical Name:
2-(3,4-DIFLUOROPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
CAS Number:
754226-39-6
Molecular Formula:
C12H15BF2O2
Molecular Weight:
240.0541
MDL Number:
MFCD12405348
IUPAC Name:
2-(3,4-difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H15BF2O2/c1-11(2)12(3,4)17-13(16-11)8-5-6-9(14)10(15)7-8/h5-7H,1-4H3
InChI Key:
VJTCPZZOSKBSCP-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.113g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.057g/mol
Monoisotopic Mass:
240.113g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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