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1150114-28-5

1150114-28-5 | Boronic acid, B-(2,6-difluoro-3-nitrophenyl)-

CAS No: 1150114-28-5 Catalog No: AG000FLV MDL No:MFCD12025957

Product Description

Catalog Number:
AG000FLV
Chemical Name:
Boronic acid, B-(2,6-difluoro-3-nitrophenyl)-
CAS Number:
1150114-28-5
Molecular Formula:
C6H4BF2NO4
Molecular Weight:
202.9081
MDL Number:
MFCD12025957
IUPAC Name:
(2,6-difluoro-3-nitrophenyl)boronic acid
InChI:
InChI=1S/C6H4BF2NO4/c8-3-1-2-4(10(13)14)6(9)5(3)7(11)12/h1-2,11-12H
InChI Key:
SPEDPBJIXAVPMJ-UHFFFAOYSA-N
SMILES:
OB(c1c(F)ccc(c1F)[N+](=O)[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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