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Home > Boronic Acids > 874959-97-4
874959-97-4 | (4-Methoxypyridin-3-yl)boronic acid hydrochloride
CAS No: 874959-97-4 Catalog No: AG003A8F MDL No:MFCD04113800
Product Description
Catalog Number:
AG003A8F
Chemical Name:
(4-Methoxypyridin-3-yl)boronic acid hydrochloride
CAS Number:
874959-97-4
Molecular Formula:
C6H9BClNO3
Molecular Weight:
189.4046
MDL Number:
MFCD04113800
IUPAC Name:
(4-methoxypyridin-3-yl)boronic acid;hydrochloride
InChI:
InChI=1S/C6H8BNO3.ClH/c1-11-6-2-3-8-4-5(6)7(9)10;/h2-4,9-10H,1H3;1H
InChI Key:
JLONCHBPEIKTEA-UHFFFAOYSA-N
SMILES:
COc1ccncc1B(O)O.Cl
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.036g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
189.402g/mol
Monoisotopic Mass:
189.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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