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Home > Boronic Acids > 870822-76-7
870822-76-7 | Boronic acid,B-[8-(trifluoromethoxy)-2-naphthalenyl]-
CAS No: 870822-76-7 Catalog No: AG004LL4 MDL No:
Product Description
Catalog Number:
AG004LL4
Chemical Name:
Boronic acid,B-[8-(trifluoromethoxy)-2-naphthalenyl]-
CAS Number:
870822-76-7
Molecular Formula:
C11H8BF3O3
Molecular Weight:
255.9856
IUPAC Name:
[8-(trifluoromethoxy)naphthalen-2-yl]boronic acid
InChI:
InChI=1S/C11H8BF3O3/c13-11(14,15)18-10-3-1-2-7-4-5-8(12(16)17)6-9(7)10/h1-6,16-17H
InChI Key:
ZCUGARUFAAMHHO-UHFFFAOYSA-N
SMILES:
OB(c1ccc2c(c1)c(ccc2)OC(F)(F)F)O
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.052g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
255.987g/mol
Monoisotopic Mass:
256.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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