6-Bromo-2-tert-butyl-4-oxo-1,4-dihydroquinoline-3-carbonitrile

• CAS: 1209597-12-5
• Catalog Number: ACM1209597125
• Category: Bromine Series

Custom Q&A

What is the molecular formula of the compound identified as PubChem CID 45789822?

The molecular formula is C14H13BrN2O.

What are the synonyms of PubChem CID 45789822?

The synonyms are 1209597-12-5, 6-Bromo-2-tert-butyl-4-oxo-1,4-dihydroquinoline-3-carbonitrile, 6-Bromo-2-(tert-butyl)-4-oxo-1,4-dihydroquinoline-3-carbonitrile, 6-bromo-2-tert-butyl-4-oxo-1H-quinoline-3-carbonitrile, DTXSID40672048.

What is the molecular weight of PubChem CID 45789822?

The molecular weight is 305.17 g/mol.

When was PubChem CID 45789822 created and last modified?

It was created on June 21, 2010, and last modified on December 2, 2023.

What is the IUPAC name of PubChem CID 45789822?

The IUPAC name is 6-bromo-2-tert-butyl-4-oxo-1H-quinoline-3-carbonitrile.

What is the InChI of PubChem CID 45789822?

The InChI is InChI=1S/C14H13BrN2O/c1-14(2,3)13-10(7-16)12(18)9-6-8(15)4-5-11(9)17-13/h4-6H,1-3H3,(H,17,18).

What is the InChIKey of PubChem CID 45789822?

The InChIKey is HQCGRLUWYHJYLO-UHFFFAOYSA-N.

What is the canonical SMILES of PubChem CID 45789822?

The canonical SMILES is CC(C)(C)C1=C(C(=O)C2=C(N1)C=CC(=C2)Br)C#N.

What is the CAS identifier of PubChem CID 45789822?

The CAS identifier is 1209597-12-5.

Is the compound's canonicalized form present in PubChem CID 45789822?

Yes, the compound is canonicalized according to PubChem.