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1072946-10-1 | 4-FLUORO-2,5-DIMETHYLPHENYLBORONIC ACID
CAS No: 1072946-10-1 Catalog No: AG007WO8 MDL No:MFCD10699621
Product Description
Catalog Number:
AG007WO8
Chemical Name:
4-FLUORO-2,5-DIMETHYLPHENYLBORONIC ACID
CAS Number:
1072946-10-1
Molecular Formula:
C8H10BFO2
Molecular Weight:
167.9732
MDL Number:
MFCD10699621
IUPAC Name:
(4-fluoro-2,5-dimethylphenyl)boronic acid
InChI:
InChI=1S/C8H10BFO2/c1-5-4-8(10)6(2)3-7(5)9(11)12/h3-4,11-12H,1-2H3
InChI Key:
VZEWNOKICGAJPJ-UHFFFAOYSA-N
SMILES:
OB(c1cc(C)c(cc1C)F)O
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.076g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.974g/mol
Monoisotopic Mass:
168.076g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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