Name: Name:DIMETHYL BENZYL CARBINYL ISOBUTYRATE
Brand: AABLOCKS
SKU: AA00E9UF
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA00E9UF

Chemical Name: DIMETHYL BENZYL CARBINYL ISOBUTYRATE

CAS Number: 59354-71-1

Molecular Formula: C14H20O2

Molecular Weight: 220.3074

MDL Number: MFCD00216759

SMILES: CC(C(=O)OC(Cc1ccccc1)(C)C)C

Properties

Complexity: 225

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 16

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 5

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 3.7

Literature fold

Title: Fragrance material review on 1,1-dimethyl-2-phenylethyl isobutyrate.

Journal: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association20120901

59354-71-1 | DIMETHYL BENZYL CARBINYL ISOBUTYRATE