Home Other Building Blocks 2-[3-(DIFLUOROMETHOXY)-4-FLUOROPHENYL]-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOR+

2-[3-(DIFLUOROMETHOXY)-4-FLUOROPHENYL]-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOR+

CAS No.:
1641580-18-8
Catalog Number:
AG01DVSN
Molecular Formula:
C13H16BF3O3
Molecular Weight:
288.0705
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Product Description
Catalog Number:
AG01DVSN
Chemical Name:
2-[3-(DIFLUOROMETHOXY)-4-FLUOROPHENYL]-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOR+
CAS Number:
1641580-18-8
Molecular Formula:
C13H16BF3O3
Molecular Weight:
288.0705
MDL Number:
MFCD24039812
IUPAC Name:
2-[3-(difluoromethoxy)-4-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H16BF3O3/c1-12(2)13(3,4)20-14(19-12)8-5-6-9(15)10(7-8)18-11(16)17/h5-7,11H,1-4H3
InChI Key:
WRIFJXGMZKAANY-UHFFFAOYSA-N
SMILES:
FC(Oc1cc(ccc1F)B1OC(C(O1)(C)C)(C)C)F
Properties
Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.114g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.073g/mol
Monoisotopic Mass:
288.114g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties