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

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

CAS: 936901-92-7

Formula: C14H17BClNO2

SMILES: CC1(C)OB(OC1(C)C)C1=CC2=CC=CC(Cl)=C2N1

IUPAC: 7-chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole

InChI: InChI=1S/C14H17BClNO2/c1-13(2)14(3,4)19-15(18-13)11-8-9-6-5-7-10(16)12(9)17-11/h5-8,17H,1-4H3

Composition: C (60.58%), H (6.17%), B (3.89%), Cl (12.77%), N (5.05%), O (11.53%)

Molar Mass: 277.56

Atom Count: 36

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	277.104086
Formal Charge	0
FSP3	0.43
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	GCBQXISUKKDBPP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.86
Topological Polar Surface Area	34.25
Polarizability	31.1
Ring Count	3
Rotatable Bond Count	1

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