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Home > Fluorides > 1218790-74-9
1218790-74-9 | Borinic acid, B,B-bis[3-fluoro-2-(trifluoromethyl)phenyl]-
CAS No: 1218790-74-9 Catalog No: AG0016AJ MDL No:MFCD15143478
Product Description
Catalog Number:
AG0016AJ
Chemical Name:
Borinic acid, B,B-bis[3-fluoro-2-(trifluoromethyl)phenyl]-
CAS Number:
1218790-74-9
Molecular Formula:
C14H7BF8O
Molecular Weight:
354.0030
MDL Number:
MFCD15143478
IUPAC Name:
bis[3-fluoro-2-(trifluoromethyl)phenyl]borinic acid
InChI:
InChI=1S/C14H7BF8O/c16-9-5-1-3-7(11(9)13(18,19)20)15(24)8-4-2-6-10(17)12(8)14(21,22)23/h1-6,24H
InChI Key:
CPVWDJSKJMCXQY-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1C(F)(F)F)F)c1cccc(c1C(F)(F)F)F
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.046g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
354.006g/mol
Monoisotopic Mass:
354.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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