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2-(4-Dimethylaminophenyl)-1H-benzimidazole-5-carboxylic acid

CAS
904817-05-6
Catalog Number
ACM904817056
Category
Other Products
Molecular Formula
C16H15N3O2

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Specification

Synonyms
2-(4-Dimethylaminophenyl)-1H-benzimidazole-5-carboxylic acid
What is the IUPAC name of the compound with PubChem CID 16740850?

The IUPAC name is 2-[4-(dimethylamino)phenyl]-3H-benzimidazole-5-carboxylic acid.

What is the molecular formula of the compound?

The molecular formula is C16H15N3O2.

When was the compound created and last modified according to the reference?

The compound was created on 2007-10-02 and last modified on 2023-12-30.

What is the molecular weight of the compound?

The molecular weight is 281.31 g/mol.

What is the InChIKey of the compound?

The InChIKey is ZNDWQRIVBOZMHM-UHFFFAOYSA-N.

What is the Canonical SMILES representation of the compound?

CN(C)C1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)O.

What is the XLogP3 value of the compound?

The XLogP3 value is 2.9.

How many hydrogen bond donor counts does the compound have?

The compound has 2 hydrogen bond donor counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 69.2 Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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