1-Heptanol
SIAL/72954 - analytical standard, ≥99.5% (GC)
Synonym: Heptyl alcohol
CAS Number: 111-70-6
Empirical Formula (Hill Notation): C7H16O
Molecular Weight: 116.20
EC Number: 203-897-9
MDL Number: MFCD00002986
Linear Formula: CH3(CH2)6OH
Product Type: Chemical
| application(s) | cleaning products cosmetics environmental flavors and fragrances food and beverages personal care |
| assay | ≥99.5% (GC) |
| autoignition temp. | 662 °F |
| bp | 176 °C (lit.) |
| density | 0.822 g/mL at 25 °C (lit.) |
| format | neat |
| grade | analytical standard |
| InChI | 1S/C7H16O/c1-2-3-4-5-6-7- |
| InChI key | BBMCTIGTTCKYKF-UHFFFAOYSA |
| mp | −36 °C (lit.) |
| Quality Level | 100  |
| refractive index | n |
| n |
|
| shelf life | limited shelf life, expiry date on the label |
| SMILES string | CCCCCCCO |
| technique(s) | gas chromatography (GC): suitable |
| HPLC: suitable | |
| vapor pressure | 0.5 mmHg ( 20 °C) |
| Application: | 1-Heptanol may be used as a model compound for the determination of alcohols with fluorescence derivatization reagent, 4-(N,N-dimethylaminosulfonyl)-7 |
| Application: | 1-Heptanol may be used as internal standard in the determination of 4-ethylphenol and 4-ethylguaiacol, which are volatile phenols in red wine samples using gas chromatography coupled with mass spectrometry(GC-MS). |
| Application: | Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support. |
| Symbol |  GHS07 |
| Signal word | Warning |
| Hazard statements | H319 |
| Precautionary statements | P305 + P351 + P338 |
| Hazard Codes | Xi |
| Risk Statements | 36-52 |
| Safety Statements | 26 |
| RIDADR | NA 1993 / PGIII |
| WGK Germany | WGK 1 |
| Flash Point(F) | 168.8 °F - closed cup |
| Flash Point(C) | 76 °C - closed cup |
| Purity | ≥99.5% (GC) |
| bp | 176 °C (lit.) |
| mp | −36 °C (lit.) |
| Density | 0.822 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 41116107 |