1-(5-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tosyl-1H-indol-3-yl)-2,2-dimethylpropan-1-one

Name: 1-(5-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tosyl-1H-indol-3-yl)-2,2-dimethylpropan-1-one
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CAS No. 2390149-39-8
Cat. No. CS-0494732
Molecule weight515.86
Purity≥98%
MDL No.None

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1-(5-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tosyl-1H-indol-3-yl)-2,2-dimethylpropan-1-one|CS-0494732

Structure of 2390149-39-8

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General Information

CAS No. 2390149-39-8
Cat. No. CS-0494732
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₂₆H₃₁BClNO₅S
Molecular Weight 515.86
Synonym(s) None
SMILES CC1=CC=C(C=C1)S(=O)(=O)N2C3C(C(C(=O)C(C)(C)C)=C2)=C(C(Cl)=CC=3)B4OC(C)(C)C(C)(C)O4

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319
Precautionary Statements : P264-P270-P280-P302+P352-P330-P362+P364-P501

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Computational Chemistry Data

TPSA 74.6
LogP 5.36812
H_Acceptors 6
H_Donors 0
Rotatable_Bonds 4

Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Functional Group Boronic Acid And Its Ester

Building Blocks Functional Group Ketone

Building Blocks Skeleton Aromatic heterocycle compounds Indole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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1-(5-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tosyl-1H-indol-3-yl)-2,2-dimethylpropan-1-one

CAS No. 2390149-39-8

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