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Home > Boronic Acids > 894808-72-1
894808-72-1 | 3-Methylpyridine-4-Boronic Acid
CAS No: 894808-72-1 Catalog No: AG0033RL MDL No:MFCD03095365
Product Description
Catalog Number:
AG0033RL
Chemical Name:
3-Methylpyridine-4-Boronic Acid
CAS Number:
894808-72-1
Molecular Formula:
C6H8BNO2
Molecular Weight:
136.9442
MDL Number:
MFCD03095365
IUPAC Name:
(3-methylpyridin-4-yl)boronic acid
InChI:
InChI=1S/C6H8BNO2/c1-5-4-8-3-2-6(5)7(9)10/h2-4,9-10H,1H3
InChI Key:
KSERCJHSQPNSJM-UHFFFAOYSA-N
SMILES:
OB(c1ccncc1C)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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