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Home > Boronic Acids > 1698908-91-6
1698908-91-6 | 2-[3-(difluoromethyl)-2-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 1698908-91-6 Catalog No: AG01C07Q MDL No:MFCD18730117
Product Description
Catalog Number:
AG01C07Q
Chemical Name:
2-[3-(difluoromethyl)-2-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1698908-91-6
Molecular Formula:
C13H16BF3O2
Molecular Weight:
272.0711
MDL Number:
MFCD18730117
IUPAC Name:
2-[3-(difluoromethyl)-2-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H16BF3O2/c1-12(2)13(3,4)19-14(18-12)9-7-5-6-8(10(9)15)11(16)17/h5-7,11H,1-4H3
InChI Key:
IOIJPWRPJQTXOS-UHFFFAOYSA-N
SMILES:
FC(c1cccc(c1F)B1OC(C(O1)(C)C)(C)C)F
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.12g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.074g/mol
Monoisotopic Mass:
272.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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