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Home > Boronic Acids > 864754-21-2
864754-21-2 | 3-((4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-pyrazol-1-yl);methyl);pyridine
CAS No: 864754-21-2 Catalog No: AG004QPN MDL No:MFCD08706029
Product Description
Catalog Number:
AG004QPN
Chemical Name:
3-((4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-pyrazol-1-yl);methyl);pyridine
CAS Number:
864754-21-2
Molecular Formula:
C15H20BN3O2
Molecular Weight:
285.1492
MDL Number:
MFCD08706029
IUPAC Name:
3-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]methyl]pyridine
InChI:
InChI=1S/C15H20BN3O2/c1-14(2)15(3,4)21-16(20-14)13-9-18-19(11-13)10-12-6-5-7-17-8-12/h5-9,11H,10H2,1-4H3
InChI Key:
LVLQAPQDEZOFQU-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cnn(c1)Cc1cccnc1
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.165g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.154g/mol
Monoisotopic Mass:
285.165g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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