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Home > Boronic Acids > 1264127-92-5
1264127-92-5 | Boronic acid, B-[5-fluoro-2-(1-methylethoxy)-4-pyridinyl]-
CAS No: 1264127-92-5 Catalog No: AG000SQX MDL No:MFCD07374987
Product Description
Catalog Number:
AG000SQX
Chemical Name:
Boronic acid, B-[5-fluoro-2-(1-methylethoxy)-4-pyridinyl]-
CAS Number:
1264127-92-5
Molecular Formula:
C8H11BFNO3
Molecular Weight:
198.9872
MDL Number:
MFCD07374987
IUPAC Name:
(5-fluoro-2-propan-2-yloxypyridin-4-yl)boronic acid
InChI:
InChI=1S/C8H11BFNO3/c1-5(2)14-8-3-6(9(12)13)7(10)4-11-8/h3-5,12-13H,1-2H3
InChI Key:
IEMIVKVJKMZTOE-UHFFFAOYSA-N
SMILES:
OB(c1cc(OC(C)C)ncc1F)O
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.082g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
198.988g/mol
Monoisotopic Mass:
199.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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