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Structure

2-(3-Bromoquinolin-6-yl)acetic acid

CAS
1022091-93-5
Catalog Number
ACM1022091935
Category
Bromine Series

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What is the molecular formula of 2-(3-Bromoquinolin-6-yl)acetic acid?

The molecular formula is C11H8BrNO2.

What is the molecular weight of 2-(3-Bromoquinolin-6-yl)acetic acid?

The molecular weight is 266.09 g/mol.

What is the IUPAC name of 2-(3-Bromoquinolin-6-yl)acetic acid?

The IUPAC name is 2-(3-bromoquinolin-6-yl)acetic acid.

What is the InChI of 2-(3-Bromoquinolin-6-yl)acetic acid?

The InChI is InChI=1S/C11H8BrNO2/c12-9-5-8-3-7(4-11(14)15)1-2-10(8)13-6-9/h1-3,5-6H,4H2,(H,14,15).

What is the InChIKey of 2-(3-Bromoquinolin-6-yl)acetic acid?

The InChIKey is PQGUOWWMXHPEKE-UHFFFAOYSA-N.

What is the canonical SMILES of 2-(3-Bromoquinolin-6-yl)acetic acid?

The canonical SMILES is C1=CC2=NC=C(C=C2C=C1CC(=O)O)Br.

What is the CAS number of 2-(3-Bromoquinolin-6-yl)acetic acid?

The CAS number is 1022091-93-5.

What is the XLogP3-AA value of 2-(3-Bromoquinolin-6-yl)acetic acid?

The XLogP3-AA value is 2.3.

Is 2-(3-Bromoquinolin-6-yl)acetic acid a canonicalized compound?

Yes, 2-(3-Bromoquinolin-6-yl)acetic acid is a canonicalized compound.

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