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Home > Boronic Acids > 1150114-69-4
1150114-69-4 | Boronic acid, B-[5-chloro-6-(1-methylethoxy)-3-pyridinyl]-
CAS No: 1150114-69-4 Catalog No: AG000FM8 MDL No:MFCD12025983
Product Description
Catalog Number:
AG000FM8
Chemical Name:
Boronic acid, B-[5-chloro-6-(1-methylethoxy)-3-pyridinyl]-
CAS Number:
1150114-69-4
Molecular Formula:
C8H11BClNO3
Molecular Weight:
215.4418
MDL Number:
MFCD12025983
IUPAC Name:
(5-chloro-6-propan-2-yloxypyridin-3-yl)boronic acid
InChI:
InChI=1S/C8H11BClNO3/c1-5(2)14-8-7(10)3-6(4-11-8)9(12)13/h3-5,12-13H,1-2H3
InChI Key:
LVUBGVPFZYGJSR-UHFFFAOYSA-N
SMILES:
CC(Oc1ncc(cc1Cl)B(O)O)C
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.052g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
215.44g/mol
Monoisotopic Mass:
215.052g/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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