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Home > Boronic Acids > 1256354-96-7

1256354-96-7

1256354-96-7 | Boronic acid, B-[2,4-dichloro-5-(trifluoromethoxy)phenyl]-

CAS No: 1256354-96-7 Catalog No: AG000O2Y MDL No:MFCD17214246

Product Description

Catalog Number:
AG000O2Y
Chemical Name:
Boronic acid, B-[2,4-dichloro-5-(trifluoromethoxy)phenyl]-
CAS Number:
1256354-96-7
Molecular Formula:
C7H4BCl2F3O3
Molecular Weight:
274.8171
MDL Number:
MFCD17214246
IUPAC Name:
[2,4-dichloro-5-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C7H4BCl2F3O3/c9-4-2-5(10)6(16-7(11,12)13)1-3(4)8(14)15/h1-2,14-15H
InChI Key:
VERJOIRDTSZURH-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c(cc1OC(F)(F)F)B(O)O

Properties

Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.958g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
274.811g/mol
Monoisotopic Mass:
273.958g/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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