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Home > Boronic Acids > 871126-20-4

871126-20-4

871126-20-4 | (2,3,5,6-Tetrafluoro-4-methoxyphenyl)boronic acid

CAS No: 871126-20-4 Catalog No: AG003BKH MDL No:MFCD07784386

Product Description

Catalog Number:
AG003BKH
Chemical Name:
(2,3,5,6-Tetrafluoro-4-methoxyphenyl)boronic acid
CAS Number:
871126-20-4
Molecular Formula:
C7H5BF4O3
Molecular Weight:
223.9174
MDL Number:
MFCD07784386
IUPAC Name:
(2,3,5,6-tetrafluoro-4-methoxyphenyl)boronic acid
InChI:
InChI=1S/C7H5BF4O3/c1-15-7-5(11)3(9)2(8(13)14)4(10)6(7)12/h13-14H,1H3
InChI Key:
AVCUUTFGJGZDMS-UHFFFAOYSA-N
SMILES:
COc1c(F)c(F)c(c(c1F)F)B(O)O

Properties

Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.027g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
223.918g/mol
Monoisotopic Mass:
224.027g/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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