PHL80717

(−)-trans-Caryophyllene

phyproof^® Reference Substance

• Synonym(s): β-Caryophyllene, trans-(1R,9S)-8-Methylene-4,11,11-trimethylbicyclo[7.2.0]undec-4-ene
• Empirical Formula (Hill Notation): C₁₅H₂₄
• CAS Number: 87-44-5
• Molecular Weight: 204.35
• Beilstein/REAXYS Number: 2044564
• MDL number: MFCD00075925
• UNSPSC Code: 41116107
• NACRES: NA.24

Properties

• grade: primary reference standard
• product line: phyproof^® Reference Substance
• assay: ≥95.0% (GC)
• manufacturer/tradename: PhytoLab
• bp: 262-264 °C (lit.)
• density: 0.902 g/mL at 20 °C (lit.)
• application(s): food and beverages
• format: neat
• storage temp.: −20°C
• SMILES string: [H][C@@]12CC\C(C)=C\CCC(=C)[C@H]1CC2(C)C
• InChI: 1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6+/t13-,14-/m1/s1
• InChI key: NPNUFJAVOOONJE-GFUGXAQUSA-N

Description

General description

This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG

Other Notes

This compound is commonly found in plants of the genus: cinnamomum melissa

Legal Information

phyproof is a registered trademark of PhytoLab GmbH & Co. KG

Safety Information

• pictograms: GHS08,GHS07
• signalword: Danger
• hcodes: H304,H317
• pcodes: P261 - P272 - P280 - P301 + P310 - P302 + P352 - P331
• Hazard Classifications: Asp. Tox. 1 - Skin Sens. 1B
• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 1
• flash_point_f: 221.9 °F - closed cup
• flash_point_c: 105.5 °C - closed cup