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5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole

5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole

CAS: 1426154-41-7

Formula: C15H20BNO2

SMILES: CC1=CC=C2NC=CC2=C1B1OC(C)(C)C(C)(C)O1

IUPAC: 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole

InChI: InChI=1S/C15H20BNO2/c1-10-6-7-12-11(8-9-17-12)13(10)16-18-14(2,3)15(4,5)19-16/h6-9,17H,1-5H3

Composition: C (70.06%), H (7.84%), B (4.20%), N (5.45%), O (12.44%)

Molar Mass: 257.14

Atom Count: 39

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 257.158709
Formal Charge 0
FSP3 0.47
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey YWRMIXQQHTZMDC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.84
Topological Polar Surface Area 34.25
Polarizability 31.02
Ring Count 3
Rotatable Bond Count 1

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97% <7 Days 1426154-41-7 $280.50-$4,597.40$280.50$425.43$667.59$969.60$2,783.50$4,597.40
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95% <5 Days 1426154-41-7 $311.47-$1,407.28$311.47$590.15$1,407.28
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