Heptyl acetate
ALDRICH/W254703 - ≥98%, FG
Synonym: n-Heptyl acetate
CAS Number: 112-06-1
Empirical Formula (Hill Notation): C9H18O2
Molecular Weight: 158.24
EC Number: 203-932-8
MDL Number: MFCD00027311
Linear Formula: C9H18O2
Product Type: Chemical
| agency | follows IFRA guidelines |
| meets purity specifications of JECFA | |
| application(s) | flavors and fragrances |
| assay | ≥98% |
| biological source | synthetic |
| bp | 192-193 °C (lit.) |
| density | 0.886 g/mL at 25 °C (lit.) |
| documentation | see Safety & Documentation for available documents |
| food allergen | no known allergens |
| fragrance allergen | no known allergens |
| grade | FG |
| Fragrance grade | |
| Halal | |
| Kosher | |
| InChI | 1S/C9H18O2/c1-3-4-5-6-7-8 |
| InChI key | ZCZSIDMEHXZRLG-UHFFFAOYSA |
| mp | −50.2 (lit.) |
| organoleptic | fatty; green; waxy; citrus; woody; wine-like |
| Quality Level | 400  |
| refractive index | n |
| reg. compliance | EU Regulation 1223/2009 |
| EU Regulation 1334/2008 & 178/2002 | |
| FDA 21 CFR 117 | |
| FDA 21 CFR 172.515 | |
| SMILES string | CCCCCCCOC(C)=O |
| vapor density | 5.5 (vs air) |
| vapor pressure | 12 mmHg ( 73 °C) |
| General description: | Heptyl acetate is one of the main volatile constituents identified in Asian pear, beer and Tosa-buntan essential oil. |
| Packaging: | 1 kg in poly bottle |
| Packaging: | 4, 9 kg in poly drum |
| WGK Germany | WGK 2 |
| Purity | ≥98% |
| bp | 192-193 °C (lit.) |
| mp | −50.2 (lit.) |
| Density | 0.886 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| FEMA Number | 2547 |
| UNSPSC | 12164502 |