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Home > Boronic Acids > 1310949-75-7
1310949-75-7 | 2-[4-(difluoromethyl)-3-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 1310949-75-7 Catalog No: AG01BIP9 MDL No:MFCD16996282
Product Description
Catalog Number:
AG01BIP9
Chemical Name:
2-[4-(difluoromethyl)-3-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1310949-75-7
Molecular Formula:
C13H16BF3O2
Molecular Weight:
272.0711
MDL Number:
MFCD16996282
IUPAC Name:
2-[4-(difluoromethyl)-3-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H16BF3O2/c1-12(2)13(3,4)19-14(18-12)8-5-6-9(11(16)17)10(15)7-8/h5-7,11H,1-4H3
InChI Key:
CTHDVQSPTKBIQC-UHFFFAOYSA-N
SMILES:
FC(c1ccc(cc1F)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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