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Home > Boronic Acids > 1309980-95-7

1309980-95-7

1309980-95-7 | Boronic acid, B-(6-ethoxy-2,3-difluorophenyl)-

CAS No: 1309980-95-7 Catalog No: AG000V97 MDL No:MFCD12026698

Product Description

Catalog Number:
AG000V97
Chemical Name:
Boronic acid, B-(6-ethoxy-2,3-difluorophenyl)-
CAS Number:
1309980-95-7
Molecular Formula:
C8H9BF2O3
Molecular Weight:
201.9631
MDL Number:
MFCD12026698
IUPAC Name:
(6-ethoxy-2,3-difluorophenyl)boronic acid
InChI:
InChI=1S/C8H9BF2O3/c1-2-14-6-4-3-5(10)8(11)7(6)9(12)13/h3-4,12-13H,2H2,1H3
InChI Key:
KVSMPXUZSFLBMK-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1B(O)O)F)F

Properties

Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.061g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
201.964g/mol
Monoisotopic Mass:
202.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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