A4700812
Heptaldehyde , standardforGC,≥98%(GC) , 111-71-7
Synonym(s):
Heptaldehyde;Enanthaldehyde;Enanthaldehyde, Heptaldehyde;1-Heptanal;Aldehyde C7
CAS NO.：111-71-7
Empirical Formula: C7H14O
Molecular Weight: 114.19
MDL number: MFCD00007028
EINECS: 203-898-4
Update time: 2022-07-08
PRODUCT Properties
| Melting point: | -43 °C (lit.) |
| Boiling point: | 153 °C (lit.) |
| Density | 0.817 g/mL at 25 °C (lit.) |
| vapor pressure | 3 hPa (20 °C) |
| FEMA | 2540 | HEPTANAL |
| refractive index | n |
| Flash point: | 95 °F |
| storage temp. | Flammables area |
| solubility | 1.25g/l insoluble；Very slightly soluble in water, soluble in alcohol and oils. |
| form | Powder, Crystals or Chunks |
| color | White to light yellow-beige |
| Odor | Green-herbaceous, vegetable-like odor |
| biological source | synthetic |
| Odor Type | green |
| explosive limit | 1.1-5.2%(V) |
| Odor Threshold | 0.00018ppm |
| Water Solubility | insoluble |
| Sensitive | Hygroscopic |
| Merck | 14,4658 |
| JECFA Number | 95 |
| BRN | 1560236 |
| Dielectric constant | 9.1（Ambient） |
| Stability: | Stable. May be light sensitive. Flammable - readily forms explosive mixtures with air. Incompatible with strong oxidizing agents, strong bases, strong reducing agents. |
| Major Application | flavors and fragrances |
| Cosmetics Ingredients Functions | PERFUMING |
| InChI | 1S/C7H14O/c1-2-3-4-5-6-7-8/h7H,2-6H2,1H3 |
| InChIKey | FXHGMKSSBGDXIY-UHFFFAOYSA-N |
| SMILES | CCCCCCC=O |
| LogP | 2.8 at 20℃ |
| CAS DataBase Reference | 111-71-7(CAS DataBase Reference) |
| NIST Chemistry Reference | Heptanal(111-71-7) |
| EPA Substance Registry System | Heptanal (111-71-7) |
Description and Uses
Heptanal has a very strong, fatty, harsh, pungent odor and an unpleasant, fatty taste. Heptanal is obtained by distilling castor oil, preferably under reduced pressure.
Heptanal is used as a synthesis intermediate in the fragrances and flavors industry. It is the precursor to 1-heptanol, ethyl heptanoate and for certain lubricants.
Safety
| Symbol(GHS) |   GHS02,GHS07 |
| Signal word | Warning |
| Hazard statements | H226-H315-H412 |
| Precautionary statements | P210-P273-P302+P352 |
| PPE | Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter |
| Hazard Codes | Xi,N |
| Risk Statements | 10-36/37/38-38-50/53 |
| Safety Statements | 26-36-37-16-61-60 |
| RIDADR | UN 3056 3/PG 3 |
| WGK Germany | 1 |
| RTECS | MI6900000 |
| Autoignition Temperature | 250 °C |
| Hazard Note | Irritant |
| TSCA | TSCA listed |
| HS Code | 2912 19 00 |
| HazardClass | 3 |
| PackingGroup | III |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Aquatic Chronic 3 Flam. Liq. 3 Skin Irrit. 2 |
| Hazardous Substances Data | 111-71-7(Hazardous Substances Data) |
| Toxicity | LD50 orally in Rabbit: > 5000 mg/kg LD50 dermal Rabbit > 5000 mg/kg |
| Limited Quantities | 5.0 L (1.3 gallons) (liquid) |
| Excepted Quantities | Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L) |
