W216003

Isobornyl acetate

• Empirical Formula (Hill Notation): C₁₂H₂₀O₂
• CAS Number: 125-12-2
• Molecular Weight: 196.29
• FEMA Number: 2160
• EC Number: 204-727-6
• Council of Europe no.: 2066
• MDL number: MFCD00135943
• UNSPSC Code: 12164502
• PubChem Substance ID: 24900676
• Flavis number: 9.218
• NACRES: NA.21

Properties

• biological source: synthetic
• Quality Level: 400
• grade: Fragrance grade; Halal; Kosher
• agency: follows IFRA guidelines
• reg. compliance: EU Regulation 1223/2009
• assay: 95%
• refractive index: n20/D 1.4635 (lit.)
• bp: 229-233 °C (lit.)
• density: 0.983 g/mL at 25 °C (lit.)
• application(s): flavors and fragrances
• documentation: see Safety & Documentation for available documents
• food allergen: no known allergens
• fragrance allergen: no known allergens
• organoleptic: camphoraceous; woody; herbaceous; sweet
• SMILES string: CC(=O)O[C@H]1C[C@@H]2CC[C@@]1(C)C2(C)C
• InChI: 1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10-,12+/m0/s1
• InChI key: KGEKLUUHTZCSIP-JBLDHEPKSA-N

Safety Information

• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 1
• flash_point_f: 192.2 °F - closed cup
• flash_point_c: 89 °C - closed cup
• ppe: Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)