Structure

3-Bromoacetylcoumarin

CAS
29310-88-1
Catalog Number
ACM29310881
Category
Bromine Series
Molecular Weight
267.07
Molecular Formula
C11H7BrO3

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What is the PubChem CID for 3-Bromoacetylcoumarin?

The PubChem CID for 3-Bromoacetylcoumarin is 2063461.

What is the molecular formula of 3-Bromoacetylcoumarin?

The molecular formula of 3-Bromoacetylcoumarin is C11H7BrO3.

What is the molecular weight of 3-Bromoacetylcoumarin?

The molecular weight of 3-Bromoacetylcoumarin is 267.07 g/mol.

What is the IUPAC name of 3-Bromoacetylcoumarin?

The IUPAC name of 3-Bromoacetylcoumarin is 3-(2-bromoacetyl)chromen-2-one.

What is the InChIKey of 3-Bromoacetylcoumarin?

The InChIKey of 3-Bromoacetylcoumarin is NTYOLVNSXVYRTJ-UHFFFAOYSA-N.

What is the Canonical SMILES of 3-Bromoacetylcoumarin?

The Canonical SMILES of 3-Bromoacetylcoumarin is C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CBr.

What is the CAS number of 3-Bromoacetylcoumarin?

The CAS number of 3-Bromoacetylcoumarin is 29310-88-1.

What is the XLogP3-AA value of 3-Bromoacetylcoumarin?

The XLogP3-AA value of 3-Bromoacetylcoumarin is 2.6.

What is the hydrogen bond acceptor count of 3-Bromoacetylcoumarin?

The hydrogen bond acceptor count of 3-Bromoacetylcoumarin is 3.

Is 3-Bromoacetylcoumarin a canonicalized compound?

Yes, 3-Bromoacetylcoumarin is a canonicalized compound.

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