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

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

CAS: 269410-24-4

Formula: C14H18BNO2

SMILES: CC1(C)OB(OC1(C)C)C1=CC=C2NC=CC2=C1

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

InChI: InChI=1S/C14H18BNO2/c1-13(2)14(3,4)18-15(17-13)11-5-6-12-10(9-11)7-8-16-12/h5-9,16H,1-4H3

Composition: C (69.17%), H (7.46%), B (4.45%), N (5.76%), O (13.16%)

Molar Mass: 243.11

Atom Count: 36

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	243.143059
Formal Charge	0
FSP3	0.43
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FATPQDPUKVVCLT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.8
Topological Polar Surface Area	34.25
Polarizability	29.25
Ring Count	3
Rotatable Bond Count	1

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