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Substance Name: Amyl propionate
RN: 624-54-4
UNII: 826P0596UJ
InChIKey: TWSRVQVEYJNFKQ-UHFFFAOYSA-N
Classification Code
- Skin / Eye Irritant
Molecular Formula
- C8-H16-O2
Molecular Weight
- 144.212
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- Amyl propionate
Synonyms
- 4-02-00-00709 (Beilstein Handbook Reference)
- AI3-24356
- Amyl propanoate
- Amyl propionate
- BRN 1747102
- EC 210-852-7
- EINECS 210-852-7
- n-Amyl propionate
- n-Amyl propionate (natural)
- n-Pentyl propanoate
- n-Pentyl propionate
- NSC 7931
- Pentyl propanate
- Pentyl propanoate
- Pentyl propionate
- UNII-826P0596UJ
Systematic Names
- Pentyl propionate
- Propanoic acid, pentyl ester
- Propionic acid, pentyl ester (6CI,7CI,8CI)
Superlist Name
- n-Pentyl propionate
Registry Numbers
CAS Registry Number
- 624-54-4
FDA UNII
- 826P0596UJ
System Generated Number
- 0000624544
Structure Descriptors
InChI
InChI=1S/C8H16O2/c1-3-5-6-7-10-8(9)4-2/h3-7H2,1-2H3InChIKey
TWSRVQVEYJNFKQ-UHFFFAOYSA-NSmiles
CCCCCOC(=O)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rabbit | LD50 | skin | > 14gm/kg (14000mg/kg) | LIVER: OTHER CHANGES GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA" MUSCULOSKELETAL: OTHER CHANGES | Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 197, 1992. |
| rat | LD50 | oral | > 14gm/kg (14000mg/kg) | BEHAVIORAL: ATAXIA BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LIVER: OTHER CHANGES | Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 197, 1992. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | -7.31E+01 | deg C | EXP | |
| Boiling Point | 168.6 | deg C | EXP | |
| log P (octanol-water) | 2.830 | (none) | EST | |
| Water Solubility | 810 | mg/L | 25 | EXP |
| Vapor Pressure | 3.6 | mm Hg | 25 | EXP |
| Henry's Law Constant | 8.43E-04 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 6.44E-12 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.