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Home > Boronic Acids > 1451393-02-4
1451393-02-4 | (3-cyclopropyl-2,6-difluorophenyl)boronic acid
CAS No: 1451393-02-4 Catalog No: AG01DDY3 MDL No:MFCD23713139
Product Description
Catalog Number:
AG01DDY3
Chemical Name:
(3-cyclopropyl-2,6-difluorophenyl)boronic acid
CAS Number:
1451393-02-4
Molecular Formula:
C9H9BF2O2
Molecular Weight:
197.9744
MDL Number:
MFCD23713139
IUPAC Name:
(3-cyclopropyl-2,6-difluorophenyl)boronic acid
InChI:
InChI=1S/C9H9BF2O2/c11-7-4-3-6(5-1-2-5)9(12)8(7)10(13)14/h3-5,13-14H,1-2H2
InChI Key:
WJRWLHHAXJKGFT-UHFFFAOYSA-N
SMILES:
OB(c1c(F)ccc(c1F)C1CC1)O
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.066g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
197.976g/mol
Monoisotopic Mass:
198.066g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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