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Home > Boronic Acids > 1002334-13-5
1002334-13-5 | 1H-Pyrazole, 1-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1002334-13-5 Catalog No: AG0001AK MDL No:MFCD16659786
Product Description
Catalog Number:
AG0001AK
Chemical Name:
1H-Pyrazole, 1-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1002334-13-5
Molecular Formula:
C15H19BN2O2
Molecular Weight:
270.1346
MDL Number:
MFCD16659786
IUPAC Name:
1-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
InChI:
InChI=1S/C15H19BN2O2/c1-14(2)15(3,4)20-16(19-14)13-10-11-18(17-13)12-8-6-5-7-9-12/h5-11H,1-4H3
InChI Key:
UBYYGXCGPBWGKO-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccn(n1)c1ccccc1
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.154g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.139g/mol
Monoisotopic Mass:
270.154g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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