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Home > Boronic Acids > 1858252-28-4
1858252-28-4 | (1-Methyl-5-phenyl-1H-pyrazol-4-yl)boronic acid
CAS No: 1858252-28-4 Catalog No: AG00I1OD MDL No:
Product Description
Catalog Number:
AG00I1OD
Chemical Name:
(1-Methyl-5-phenyl-1H-pyrazol-4-yl)boronic acid
CAS Number:
1858252-28-4
Molecular Formula:
C10H11BN2O2
Molecular Weight:
202.0175
IUPAC Name:
(1-methyl-5-phenylpyrazol-4-yl)boronic acid
InChI:
InChI=1S/C10H11BN2O2/c1-13-10(8-5-3-2-4-6-8)9(7-12-13)11(14)15/h2-7,14-15H,1H3
InChI Key:
NBRBMOLQILZVPM-UHFFFAOYSA-N
SMILES:
Cn1ncc(c1c1ccccc1)B(O)O
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.091g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
202.02g/mol
Monoisotopic Mass:
202.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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