80595

(1S)-(−)-trans-Pinane

analytical standard

• Synonym(s): (1S,2S)-2,6,6-Trimethylbicyclo[3.1.1]heptane
• Empirical Formula (Hill Notation): C₁₀H₁₈
• CAS Number: 10281-53-5
• Molecular Weight: 138.25
• Beilstein/REAXYS Number: 2321791
• EC Number: 233-629-6
• MDL number: MFCD00066421
• UNSPSC Code: 85151701
• PubChem Substance ID: 329768977
• NACRES: NA.24

Properties

• grade: analytical standard
• Quality Level: 100
• assay: ≥98.5% (sum of enantiomers, GC)
• optical activity: [α]20/D −17±1°, neat
• shelf life: limited shelf life, expiry date on the label
• technique(s): HPLC: suitable; gas chromatography (GC): suitable
• refractive index: n20/D 1.461
• bp: 165-167 °C (lit.)
• density: 0.854 g/mL at 20 °C (lit.)
• application(s): food and beverages
• format: neat
• SMILES string: [H][C@]12CC[C@H](C)[C@]([H])(C1)C2(C)C
• InChI: 1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3/t7-,8-,9-/m0/s1
• InChI key: XOKSLPVRUOBDEW-CIUDSAMLSA-N

Description

Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Safety Information

• pictograms: GHS02
• signalword: Warning
• hcodes: H226
• Hazard Classifications: Flam. Liq. 3
• Storage Class: 3 - Flammable liquids
• wgk_germany: WGK 3
• flash_point_f: 118.4 °F - closed cup
• flash_point_c: 48 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter