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Home > Boronic Acids > 276694-22-5
276694-22-5 | Boronic acid, B-[4-(1,3,4-oxadiazol-2-yl)phenyl]-
CAS No: 276694-22-5 Catalog No: AG002UDO MDL No:MFCD11865276
Product Description
Catalog Number:
AG002UDO
Chemical Name:
Boronic acid, B-[4-(1,3,4-oxadiazol-2-yl)phenyl]-
CAS Number:
276694-22-5
Molecular Formula:
C8H7BN2O3
Molecular Weight:
189.9638
MDL Number:
MFCD11865276
IUPAC Name:
[4-(1,3,4-oxadiazol-2-yl)phenyl]boronic acid
InChI:
InChI=1S/C8H7BN2O3/c12-9(13)7-3-1-6(2-4-7)8-11-10-5-14-8/h1-5,12-13H
InChI Key:
WXOMKINBRCKWNI-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)c1nnco1)O
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.055g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
189.965g/mol
Monoisotopic Mass:
190.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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