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Home > Boronic Acids > 1010110-74-3
1010110-74-3 | Boronic acid, B-(2,6-difluoro-4-propylphenyl)-
CAS No: 1010110-74-3 Catalog No: AG0003J4 MDL No:MFCD21337851
Product Description
Catalog Number:
AG0003J4
Chemical Name:
Boronic acid, B-(2,6-difluoro-4-propylphenyl)-
CAS Number:
1010110-74-3
Molecular Formula:
C9H11BF2O2
Molecular Weight:
199.9902
MDL Number:
MFCD21337851
IUPAC Name:
(2,6-difluoro-4-propylphenyl)boronic acid
InChI:
InChI=1S/C9H11BF2O2/c1-2-3-6-4-7(11)9(10(13)14)8(12)5-6/h4-5,13-14H,2-3H2,1H3
InChI Key:
MGAVQINVJUZEGY-UHFFFAOYSA-N
SMILES:
CCCc1cc(F)c(c(c1)F)B(O)O
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.082g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.992g/mol
Monoisotopic Mass:
200.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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