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Home > Boronic Acids > 1095080-54-8
1095080-54-8 | B-(1-Ethyl-1H-pyrazol-5-yl)boronic acid
CAS No: 1095080-54-8 Catalog No: AG0039CH MDL No:MFCD03419491
Product Description
Catalog Number:
AG0039CH
Chemical Name:
B-(1-Ethyl-1H-pyrazol-5-yl)boronic acid
CAS Number:
1095080-54-8
Molecular Formula:
C5H9BN2O2
Molecular Weight:
139.9482
MDL Number:
MFCD03419491
IUPAC Name:
(2-ethylpyrazol-3-yl)boronic acid
InChI:
InChI=1S/C5H9BN2O2/c1-2-8-5(6(9)10)3-4-7-8/h3-4,9-10H,2H2,1H3
InChI Key:
ZMKALWZRSCXBEY-UHFFFAOYSA-N
SMILES:
CCn1nccc1B(O)O
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.076g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
139.949g/mol
Monoisotopic Mass:
140.076g/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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