Structure

4-Bromoisatin

CAS
20780-72-7
Catalog Number
ACM20780727
Category
Bromine Series

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What is the molecular formula of 4-Bromoisatin?

The molecular formula of 4-Bromoisatin is C8H4BrNO2.

What is the molecular weight of 4-Bromoisatin?

The molecular weight of 4-Bromoisatin is 226.03 g/mol.

What is the IUPAC name of 4-Bromoisatin?

The IUPAC name of 4-Bromoisatin is 4-bromo-1H-indole-2,3-dione.

What is the InChIKey of 4-Bromoisatin?

The InChIKey of 4-Bromoisatin is ITRAKBJPMLKWIW-UHFFFAOYSA-N.

What is the Canonical SMILES representation of 4-Bromoisatin?

The Canonical SMILES representation of 4-Bromoisatin is C1=CC2=C(C(=C1)Br)C(=O)C(=O)N2.

What is the CAS number of 4-Bromoisatin?

The CAS number of 4-Bromoisatin is 20780-72-7.

How many hydrogen bond donor counts does 4-Bromoisatin have?

4-Bromoisatin has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 4-Bromoisatin have?

4-Bromoisatin has 2 hydrogen bond acceptor counts.

How many rotatable bond counts does 4-Bromoisatin have?

4-Bromoisatin has 0 rotatable bond counts.

Is 4-Bromoisatin a canonicalized compound?

Yes, 4-Bromoisatin is a canonicalized compound.

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