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Home > Boronic Acids > 1150114-60-5

1150114-60-5

1150114-60-5 | Boronic acid, B-(3,5-difluoro-2-nitrophenyl)-

CAS No: 1150114-60-5 Catalog No: AG000FMH MDL No:MFCD12025971

Product Description

Catalog Number:
AG000FMH
Chemical Name:
Boronic acid, B-(3,5-difluoro-2-nitrophenyl)-
CAS Number:
1150114-60-5
Molecular Formula:
C6H4BF2NO4
Molecular Weight:
202.9081
MDL Number:
MFCD12025971
IUPAC Name:
(3,5-difluoro-2-nitrophenyl)boronic acid
InChI:
InChI=1S/C6H4BF2NO4/c8-3-1-4(7(11)12)6(10(13)14)5(9)2-3/h1-2,11-12H
InChI Key:
QSDKRMBLAFJYCE-UHFFFAOYSA-N
SMILES:
Fc1cc(B(O)O)c(c(c1)F)[N+](=O)[O-]

Properties

Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
202.908g/mol
Monoisotopic Mass:
203.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
86.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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