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Home > Boronic Acids > 1256358-50-5
1256358-50-5 | Boronic acid, B-[3-[(2,3-difluorophenyl)methoxy]phenyl]-
CAS No: 1256358-50-5 Catalog No: AG000O5W MDL No:MFCD12695925
Product Description
Catalog Number:
AG000O5W
Chemical Name:
Boronic acid, B-[3-[(2,3-difluorophenyl)methoxy]phenyl]-
CAS Number:
1256358-50-5
Molecular Formula:
C13H11BF2O3
Molecular Weight:
264.0324
MDL Number:
MFCD12695925
IUPAC Name:
[3-[(2,3-difluorophenyl)methoxy]phenyl]boronic acid
InChI:
InChI=1S/C13H11BF2O3/c15-12-6-1-3-9(13(12)16)8-19-11-5-2-4-10(7-11)14(17)18/h1-7,17-18H,8H2
InChI Key:
HCKLCQNNWBHEBX-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)OCc1cccc(c1F)F)O
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.077g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.035g/mol
Monoisotopic Mass:
264.077g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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