Isobutyl benzoate

• CAS: 120-50-3
• Catalog Number: ACM120503
• Category: Other Products
• Molecular Weight: 178.23
• Molecular Formula: C11H14O2
• Synonyms: Benzoic acid isobutyl
• IUPAC Name: 2-Methylpropyl benzoate
• Canonical SMILES: CC(C)COC(=O)C1=CC=CC=C1
• InChI: InChI=1S/C11H14O2/c1-9(2)8-13-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
• InChI Key: KYZHGEFMXZOSJN-UHFFFAOYSA-N
• Boiling Point: 241-242 °C
• Flash Point: 205 °F
• Density: 0.996 g/mL at 25 °C(lit.)
• Solubility: Insoluble in water; soluble in organic solvents, oils
• Appearance: Clear colorless liquid
• Active Content: 95%
• Assay: 0.98
• Exact Mass: 178.099379685
• Monoisotopic Mass: 178.099379685
• Odor: Green, floral, leafy odor
• Packaging: 100 g
• Physical State: Liquid
• Refractive Index: n20/D 1.495(lit.)
• Topological Polar Surface Area: 26.3 Ų

Custom Q&A

What is the IUPAC name for isobutyl benzoate?

The IUPAC name for isobutyl benzoate is 2-Methylpropyl benzoate.

What is the CAS number for isobutyl benzoate?

The CAS number for isobutyl benzoate is 120-50-3.

What is the molecular weight of isobutyl benzoate?

The molecular weight of isobutyl benzoate is 178.23.

What is the density of isobutyl benzoate at 25°C?

The density of isobutyl benzoate at 25°C is 0.996 g/mL.

What is the boiling point of isobutyl benzoate?

The boiling point of isobutyl benzoate is 241-242°C.

What is the appearance of isobutyl benzoate?

The appearance of isobutyl benzoate is a clear colorless liquid.

What are some typical applications of isobutyl benzoate?

Some typical applications of isobutyl benzoate include use as perfume, preservative, and solvent.

What percentage of isobutyl benzoate is considered active?

Isobutyl benzoate is considered to be 95% active.

What is the InChI key for isobutyl benzoate?

The InChI key for isobutyl benzoate is KYZHGEFMXZOSJN-UHFFFAOYSA-N.

What is another name for isobutyl benzoate?

Another synonym for isobutyl benzoate is Benzoic acid isobutyl.