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Home > Boronic Acids > 173999-18-3
173999-18-3 | Boronic acid, B-(5-methyl-3-pyridinyl)-
CAS No: 173999-18-3 Catalog No: AG001ZCY MDL No:MFCD03428528
Product Description
Catalog Number:
AG001ZCY
Chemical Name:
Boronic acid, B-(5-methyl-3-pyridinyl)-
CAS Number:
173999-18-3
Molecular Formula:
C6H8BNO2
Molecular Weight:
136.9442
MDL Number:
MFCD03428528
IUPAC Name:
(5-methylpyridin-3-yl)boronic acid
InChI:
InChI=1S/C6H8BNO2/c1-5-2-6(7(9)10)4-8-3-5/h2-4,9-10H,1H3
InChI Key:
REONQWGHSQHTAC-UHFFFAOYSA-N
SMILES:
OB(c1cncc(c1)C)O
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.065g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
136.945g/mol
Monoisotopic Mass:
137.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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