7-Chloroindole-3-carboxylic acid

• CAS: 86153-24-4
• Catalog Number: ACM86153244
• Category: Indoles
• Molecular Weight: 195.60
• Molecular Formula: C9H6ClNO2
• Synonyms: 1H-Indole-3-carboxylicacid, 7-chloro-;7-Chloro-1H-indole-3-carboxylicacid;1H-Indole-3-carboxylic acid, 7-chloro-
• Boiling Point: 449.7 °C at 760 mmHg
• Flash Point: 225.8 °C
• Density: 1.548 g/cm³

Custom Q&A

What is the molecular formula of 7-Chloroindole-3-carboxylic acid?

The molecular formula is C9H6ClNO2.

When was this compound created in the PubChem database?

It was created on May 27, 2009.

What is the molecular weight of 7-Chloroindole-3-carboxylic acid?

The molecular weight is 195.60 g/mol.

What is the IUPAC name of this compound?

The IUPAC name is 7-chloro-1H-indole-3-carboxylic acid.

What is the structure of 7-Chloroindole-3-carboxylic acid?

The structure is represented by the Canonical SMILES C1=CC2=C(C(=C1)Cl)NC=C2C(=O)O.

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

There are 2 hydrogen bond donor counts.

How many rotatable bond counts are in 7-Chloroindole-3-carboxylic acid?

There is 1 rotatable bond count.

What is the topological polar surface area of this compound?

The topological polar surface area is 53.1 Ų.

Is the compound canonicalized in the PubChem database?

Yes, the compound is canonicalized.

What is the InChIKey of 7-Chloroindole-3-carboxylic acid?

The InChIKey is DBCJWTBYVXEBJY-UHFFFAOYSA-N.