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2-{[(tert-butyldimethylsilyl)oxy]methyl}-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine

2-{[(tert-butyldimethylsilyl)oxy]methyl}-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine

Formula: C17H31BN2O3Si

SMILES: CC(C)(C)[Si](C)(C)OCC1=NC=C(C=N1)B1OC(C)(C)C(C)(C)O1

IUPAC: 2-{[(tert-butyldimethylsilyl)oxy]methyl}-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine

InChI: InChI=1S/C17H31BN2O3Si/c1-15(2,3)24(8,9)21-12-14-19-10-13(11-20-14)18-22-16(4,5)17(6,7)23-18/h10-11H,12H2,1-9H3

Composition: C (58.28%), H (8.92%), B (3.09%), N (8.00%), O (13.70%), Si (8.02%)

Molar Mass: 350.34

Atom Count: 55

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 350.219699
Formal Charge 0
FSP3 0.76
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey PETKWKMLVRMTIH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 88.55
Topological Polar Surface Area 53.47
Polarizability 38.73
Ring Count 2
Rotatable Bond Count 5

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97% <7 Days C17H31BN2O3Si $184.20-$371.20$184.20$371.20
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