4-(Phenylhydrazono)pentanoic acid

• Catalog Number: ACMA00000953
• Category: Amines
• Molecular Weight: 206.24
• Molecular Formula: C₁₁H₁₃NO₃S
• Density: 313
• Hazard Statements: H319
• RIDADR: UN 3077 9 / PGIII
• Symbol: GHS07

Custom Q&A

What is the molecular formula of the compound?

The molecular formula is C11H14N2O2.

What are the synonyms of the compound?

Some synonyms of the compound include Antithermin, levulinic acid phenylhydrazone, Levulinic Acid Phenylhydrazone, and Lactam.

What is the molecular weight of the compound?

The molecular weight is 206.24 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is (4E)-4-(phenylhydrazinylidene)pentanoic acid.

What is the InChI code of the compound?

The InChI code is InChI=1S/C11H14N2O2/c1-9(7-8-11(14)15)12-13-10-5-3-2-4-6-10/h2-6,13H,7-8H2,1H3,(H,14,15)/b12-9+.

What is the InChIKey of the compound?

The InChIKey is KBIUZPWRIZWXRB-FMIVXFBMSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is CC(=NNC1=CC=CC=C1)CCC(=O)O.

What is the isomeric SMILES of the compound?

The isomeric SMILES is C/C(=N\NC1=CC=CC=C1)/CCC(=O)O.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 1.5.

Is the compound's formal charge 0?

Yes, the formal charge of the compound is 0.