Thymol
SIAL/50409 - Standard for quantitative NMR, TraceCERT®, Manufactured by: Sigma-Aldrich Production GmbH, Switzerland
Synonym: 2-
CAS Number: 89-83-8
Empirical Formula (Hill Notation): C10H14O
Molecular Weight: 150.22
EC Number: 201-944-8
MDL Number: MFCD00002309
Linear Formula: 2-[(CH3)2CH]C6H3-5-(CH3)OH
Product Type: Chemical
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 50409-1G
| application(s) | cleaning products cosmetics environmental flavors and fragrances food and beverages personal care pharmaceutical |
| bp | 232 °C (lit.) |
| density | 0.965 g/mL at 25 °C (lit.) |
| description | qNMR Standard |
| format | neat |
| grade | certified reference material |
| Standard for quantitative NMR | |
| InChI | 1S/C10H14O/c1-7(2)9-5-4-8 |
| InChI key | MGSRCZKZVOBKFT-UHFFFAOYSA |
| manufacturer/tradename | Manufactured by: Sigma-Aldrich Production GmbH, Switzerland |
| mp | 48-51 °C (lit.) |
| product line | TraceCERT® |
| Quality Level | 300  |
| shelf life | limited shelf life, expiry date on the label |
| SMILES string | CC(C)c1ccc(C)cc1O |
| technique(s) | LC/MS: suitable |
| qNMR: suitable | |
| vapor pressure | 1 mmHg ( 64 °C) |
| Application: | Thymol has been used as certified reference material for the quantification of the analyte in essential oil from the leaves of Mentha longifolia Huds. (Lamiaceae) and Mentha spicata L. (Lamiaceae) using gas chromatography coupled to mass spectrometry (GC-MS). |
| General description: | This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to primary material from an NMI, e.g. NIST or NMIJ. Certified content by quantitative NMR incl. uncertainty and expiry date are given on the certificate. Download your certificate at: http://www.sigma-aldrich. Check out our entire range of quantitative NMR standards (qNMR standards) |
| General description: | Thymol, a phenolic monoterpene derivative of cymene and an isomer of carvacrol, is a common constituent of the essential oils, derived from Thymus and Origanum plants. It is a flavoring compound and its content is directly proportional to the characteristic flavor and quality of thyme and ajwain essential oils. Thymol finds a variety of applications in pharmaceuticals, cosmetics, and the food industry. |
| Legal Information: | TraceCERT is a registered trademark of Merck KGaA, Darmstadt, Germany |
| Recommended products: | Check out ChemisTwin, our brand new online portal for identity confirmation of NMR spectra. A feature for quantitative NMR is in development. Learn more or reach out to us for a free trial . |
| Symbol |    GHS05,GHS07,GHS09 |
| Signal word | Danger |
| Hazard statements | H302 - H314 - H411 |
| Precautionary statements | P260 - P273 - P280 - P301 + P312 - P303 + P361 + P353 - P305 + P351 + P338 |
| Hazard Codes | C,N |
| Risk Statements | 22-34-51/53 |
| Safety Statements | 26-28-36/37/39-45-61 |
| RIDADR | UN2430 - class 8 - PG 3 - EHS - Alkylphenols, solid, n.o.s., HI: |
| WGK Germany | WGK 2 |
| Flash Point(F) | 240.8 °F - closed cup |
| Flash Point(C) | 116 °C - closed cup |
| bp | 232 °C (lit.) |
| mp | 48-51 °C (lit.) |
| Density | 0.965 g/mL at 25 °C (lit.) |
| UNSPSC | 12142201 |