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Home > Boronic Acids > 1228183-01-4
1228183-01-4 | Boronic acid, B-[4-(1H-imidazol-1-ylmethyl)phenyl]-
CAS No: 1228183-01-4 Catalog No: AG000JJF MDL No:MFCD14687238
Product Description
Catalog Number:
AG000JJF
Chemical Name:
Boronic acid, B-[4-(1H-imidazol-1-ylmethyl)phenyl]-
CAS Number:
1228183-01-4
Molecular Formula:
C10H11BN2O2
Molecular Weight:
202.0175
MDL Number:
MFCD14687238
IUPAC Name:
[4-(imidazol-1-ylmethyl)phenyl]boronic acid
InChI:
InChI=1S/C10H11BN2O2/c14-11(15)10-3-1-9(2-4-10)7-13-6-5-12-8-13/h1-6,8,14-15H,7H2
InChI Key:
WOPRITIOYMANHW-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)Cn1cncc1)O
Properties
Complexity:
196
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:
3
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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