W450210

Sclareol

natural, ≥95%, FG

• Synonym(s): Labd-14-ene-8,13-diol, (1R,2R,8aS)-Decahydro-1-(3-hydroxy-3-methyl-4-pentenyl)-2,5,5,8a-tetramethyl-2-naphthol
• Empirical Formula (Hill Notation): C₂₀H₃₆O₂
• CAS Number: 515-03-7
• Molecular Weight: 308.50
• FEMA Number: 4502
• Beilstein/REAXYS Number: 2054148
• MDL number: MFCD00869558
• UNSPSC Code: 12164502
• Flavis number: 02.206
• NACRES: NA.21

Properties

• biological source: Salvia sclarea L
• Quality Level: 400
• grade: FG; Halal; Kosher; natural
• reg. compliance: EU Regulation 1334/2008 & 178/2002; FDA 21 CFR 117
• assay: ≥95%
• bp: 218-220 °C/19 mmHg (lit.)
• mp: 95-100 °C (lit.)
• application(s): flavors and fragrances
• documentation: see Safety & Documentation for available documents
• food allergen: no known allergens
• organoleptic: woody; balsamic; earthy
• SMILES string: CC1(C)CCC[C@@]2(C)[C@H]1CC[C@@](C)(O)[C@@H]2CC[C@@](C)(O)C=C
• InChI: 1S/C20H36O2/c1-7-18(4,21)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)22/h7,15-16,21-22H,1,8-14H2,2-6H3/t15-,16+,18-,19-,20+/m0/s1
• InChI key: XVULBTBTFGYVRC-HHUCQEJWSA-N

Safety Information

• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 2
• flash_point_f: Not applicable
• flash_point_c: Not applicable