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Structure

1-(tert-Butyldimethylsilyl)-1H-indol-5-ylboronic acid

CAS
913835-68-4
Catalog Number
ACM913835684
Category
Other Products
Molecular Weight
275.2298
Molecular Formula
C14H22BNO2Si

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Specification

Synonyms
913835-68-4, 1-(TERT-BUTYLDIMETHYLSILYL)-1H-INDOL-5-YLBORONIC ACID, (1-(tert-Butyldimethylsilyl)-1H-indol-5-yl)boronic acid, 1-(tert-Butyldimethylsilyl)-1H-indol-5-yl-5-boronic acid, AC1NA7EZ, CTK3I6386, MolPort-001-768-258, 1-TBDMS-indole-5-boronic acid,, ANW-43596, OR3317, AKOS015894148, RP06554, AK-92486, KB-13283, Y4671, B-5621, 1-(tert-butyldimethylsilyl)indol-5-ylboronic acid, 5-Borono-1-[(tert-butyl)dimethylsilyl]-1H-indole, (5-Borono-1H-indol-1-yl)(tert-butyl)dimethylsilane, I04-6908
IUPAC Name
[1-[tert-butyl(dimethyl)silyl]indol-5-yl]boronic acid
InChI Key
PPFZQIOBIOETAS-UHFFFAOYSA-N
Boiling Point
352.1ºC at 760 mmHg
Melting Point
248-250ºC
Flash Point
166.7ºC
Density
1.01g/cm³
Exact Mass
275.15100
Hazard Statements
Xi
H-Bond Acceptor
2
H-Bond Donor
2
What is the molecular formula of 1-(tert-Butyldimethylsilyl)-1H-indol-5-ylboronic acid?

The molecular formula is C14H22BNO2Si.

When was the compound first created?

The compound was first created on September 14, 2005.

What is the IUPAC name of the compound?

The IUPAC name is [1-[tert-butyl(dimethyl)silyl]indol-5-yl]boronic acid.

What is the molecular weight of the compound?

The molecular weight is 275.23 g/mol.

What is the InChIKey of the compound?

The InChIKey is PPFZQIOBIOETAS-UHFFFAOYSA-N.

What is the Canonical SMILES of the compound?

The Canonical SMILES is B(C1=CC2=C(C=C1)N(C=C2)[Si](C)(C)C(C)(C)C)(O)O.

How many hydrogen bond donor counts are there in the compound?

There are 2 hydrogen bond donor counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 45.4 Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the CAS number of the compound?

The CAS number is 913835-68-4.

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