(Z)-6-octenal
information only not used for fragrances or flavors
| 2D: |
 |
| 3D: |
|
| CAS Number: |
63196-64-5
|
| ECHA EC Number: |
263-994-7 |
| FDA UNII: |
1X6813002I |
| Category: |
information only not used for fragrances or flavors |
| IUPAC Name: |
(Z)-6-octenal |
| InChI : |
InChI=1/C8H14O/c1-2-3-4-5-6-7-8-9/h2-3,8H,4-7H2,1H3/b3-2- |
| Std.InChI: |
InChI=1S/C8H14O/c1-2-3-4-5-6-7-8-9/h2-3,8H,4-7H2,1H3/b3-2- |
| InChIKey : |
KVNBGNGISDIZRP-IHWYPQMZBP |
| Std.InChIKey: |
KVNBGNGISDIZRP-IHWYPQMZSA-N |
| SMILES : |
C/C=C\CCCCC=O |
| Molar Refractivity : |
39.35 ± 0.3 cm3 (est) |
| Parachor : |
346.5 ± 4.0 cm3 (est) |
| Index of Refraction : |
1.432 ± 0.02 (est) |
| Surface Tension : |
27.3 ± 3.0 dyne/cm (est) |
| Density : |
0.832 ± 0.06 g/cm3 (est) |
| Polarizability : |
15.60 ± 0.5 10-24cm3 (est) |
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
| Appearance: | colorless to pale yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 169.00 to 172.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 1.352000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 121.00 °F. TCC ( 49.60 °C. ) (est) |
| logP (o/w): | 2.580 |
| Soluble in: |
| | alcohol |
| | water, 612.7 mg/L @ 25 °C (est) |
| Insoluble in: |
| | water |
Safety Information:
| |
| Hazards identification |
| |
| Classification of the substance or mixture |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) |
| None found. |
| GHS Label elements, including precautionary statements |
| |
| Pictogram | |
| |
| Hazard statement(s) |
| None found. |
| Precautionary statement(s) |
| None found. |
| Oral/Parenteral Toxicity: |
| Not determined |
| Dermal Toxicity: |
| Not determined |
| Inhalation Toxicity: |
| Not determined |
Safety in Use Information:
| Category: |
| information only not used for fragrances or flavors |
| Recommendation for (Z)-6-octenal usage levels up to: |
| | not for fragrance use. |
| |
| Recommendation for (Z)-6-octenal flavor usage levels up to: |
| | not for flavor use. |
Potential Blenders and core components :
Occurrence (nature, food, other):
Synonyms:
| (6Z)- | oct-6-enal |
| (Z)- | oct-6-enal |
| (Z)-6- | octen-1-al |
| cis-6- | octen-1-al |
| cis-6- | octenal |
| 6- | octenal, (6Z)- |
| 6- | octenal, (Z)- |
