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Home > Boronic Acids > 720702-41-0
720702-41-0 | (1-Methyl-1H-pyrazol-5-yl)boronic acid
CAS No: 720702-41-0 Catalog No: AG0036M3 MDL No:MFCD11053031
Product Description
Catalog Number:
AG0036M3
Chemical Name:
(1-Methyl-1H-pyrazol-5-yl)boronic acid
CAS Number:
720702-41-0
Molecular Formula:
C4H7BN2O2
Molecular Weight:
125.9216
MDL Number:
MFCD11053031
IUPAC Name:
(2-methylpyrazol-3-yl)boronic acid
InChI:
InChI=1S/C4H7BN2O2/c1-7-4(5(8)9)2-3-6-7/h2-3,8-9H,1H3
InChI Key:
MGNBKNBEZGLHNF-UHFFFAOYSA-N
SMILES:
OB(c1ccnn1C)O
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.06g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
125.922g/mol
Monoisotopic Mass:
126.06g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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