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1256355-12-0

1256355-12-0 | Boronic acid, B-[5-iodo-2-(trifluoromethoxy)phenyl]-

CAS No: 1256355-12-0 Catalog No: AG000O3W MDL No:MFCD17926487

Product Description

Catalog Number:
AG000O3W
Chemical Name:
Boronic acid, B-[5-iodo-2-(trifluoromethoxy)phenyl]-
CAS Number:
1256355-12-0
Molecular Formula:
C7H5BF3IO3
Molecular Weight:
331.8235
MDL Number:
MFCD17926487
IUPAC Name:
[5-iodo-2-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C7H5BF3IO3/c9-7(10,11)15-6-2-1-4(12)3-5(6)8(13)14/h1-3,13-14H
InChI Key:
HFPPAYYLWWNTBZ-UHFFFAOYSA-N
SMILES:
Ic1ccc(c(c1)B(O)O)OC(F)(F)F

Properties

Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.933g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
331.824g/mol
Monoisotopic Mass:
331.933g/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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