B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(N2)C(=CC=C3)Cl
CAS: 936901-92-7
الاسم: 7-chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(N2)C(=CC=C3)Cl

Molecular Processing

Molecular formula
C14H17BClNO2
Molecular weight
277.56
Exact mass
277.1041
XLogP
3.12
TPSA
34.25
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
79.02

Supplementary Information

InChIKey: GCBQXISUKKDBPP-UHFFFAOYSA-N
مرادفات
936901-92-77-CHLORO-2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-INDOLE7-CHLOROINDOLE-2-BORONIC ACID, PINACOL ESTERMFCD16295113(7-CHLORO-1H-INDOL-2-YL)BORONIC ACID PINACOL ESTERSCHEMBL594777DTXSID70682312GCBQXISUKKDBPP-UHFFFAOYSA-NAKOS015999652MB14881AS-43246DB-359837CS-0175001F2159767-Chloro-2-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1H-indole7-chloro-2-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl)-1H-indole
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