propyl 4-pentenoate
information only not used for fragrances or flavors
| 2D: |
 |
| 3D: |
|
| CAS Number: |
62030-43-7
|
| FDA UNII: |
Search |
| Category: |
information only not used for fragrances or flavors |
| IUPAC Name: |
propyl 4-pentenoate |
| InChI : |
InChI=1/C8H14O2/c1-3-5-6-8(9)10-7-4-2/h3H,1,4-7H2,2H3 |
| Std.InChI: |
InChI=1S/C8H14O2/c1-3-5-6-8(9)10-7-4-2/h3H,1,4-7H2,2H3 |
| InChIKey : |
CAZFANXQUXBGQQ-UHFFFAOYAJ |
| Std.InChIKey: |
CAZFANXQUXBGQQ-UHFFFAOYSA-N |
| SMILES : |
CCCOC(=O)CCC=C |
| Molar Refractivity : |
40.61 ± 0.3 cm3 (est) |
| Parachor : |
364.1 ± 4.0 cm3 (est) |
| Index of Refraction : |
1.423 ± 0.02 (est) |
| Surface Tension : |
27.4 ± 3.0 dyne/cm (est) |
| Density : |
0.893 ± 0.06 g/cm3 (est) |
| Polarizability : |
16.09 ± 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: | 147.00 to 148.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 4.374000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 116.00 °F. TCC ( 46.80 °C. ) (est) |
| logP (o/w): | 2.388 (est) |
| Soluble in: |
| | alcohol |
| | water, 411.7 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 propyl 4-pentenoate usage levels up to: |
| | not for fragrance use. |
| |
| Recommendation for propyl 4-pentenoate flavor usage levels up to: |
| | not for flavor use. |
Potential Blenders and core components :
Occurrence (nature, food, other):
Synonyms:
| 4- | pentenoic acid propyl ester |
| | propyl pent-4-enoate |
