CAS 149-57-5|2-Ethylcaproic acid
| Common Name | 2-Ethylcaproic acid | ||
|---|---|---|---|
| CAS Number | 149-57-5 | Molecular Weight | 144.211 |
| Density | 0.9±0.1 g/cm3 | Boiling Point | 228.0±0.0 °C at 760 mmHg |
| Molecular Formula | C8H16O2 | Melting Point | -59 °C |
| MSDS | ChineseUSA | Flash Point | 116.6±6.9 °C |
| Symbol | GHS08 | Signal Word | Warning |
Names
| Name | 2-Ethylhexanoic acid |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 0.9±0.1 g/cm3 |
|---|---|
| Boiling Point | 228.0±0.0 °C at 760 mmHg |
| Melting Point | -59 °C |
| Molecular Formula | C8H16O2 |
| Molecular Weight | 144.211 |
| Flash Point | 116.6±6.9 °C |
| Exact Mass | 144.115036 |
| PSA | 37.30000 |
| LogP | 2.72 |
| Vapour density | 4.98 (vs air) |
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
| Index of Refraction | 1.435 |
| InChIKey | OBETXYAYXDNJHR-UHFFFAOYSA-N |
| SMILES | CCCCC(CC)C(=O)O |
| Stability | Stable. Combustible. Incompatible with strong oxidizing agents, reducing agents, bases. |
| Water Solubility | 2 g/L (20 ºC) |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- Open irritation test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- TYPE OF TEST :
- Open irritation test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration into the eye
- SPECIES OBSERVED :
- Rodent - rabbit
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 3 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LC - Lethal concentration
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >400 ppm/6H
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 1260 uL/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - guinea pig
- DOSE/DURATION :
- 6300 uL/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 25200 mg/kg/3W-C
- TOXIC EFFECTS :
- Blood - changes in serum composition (e.g. TP, bilirubin, cholesterol)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 8800 mg/kg/2W-I
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Liver - changes in liver weight Skin and Appendages - hair
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 81116 mg/kg/2W-C
- TOXIC EFFECTS :
- Liver - changes in liver weight Nutritional and Gross Metabolic - weight loss or decreased weight gain
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 1803 mg/kg
- SEX/DURATION :
- female 12 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Specific Developmental Abnormalities - musculoskeletal system Reproductive - Specific Developmental Abnormalities - cardiovascular (circulatory) system Reproductive - Specific Developmental Abnormalities - urogenital system
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 5 gm/kg
- SEX/DURATION :
- female 6-15 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
MUTATION DATA - TYPE OF TEST :
- Sister chromatid exchange
- TEST SYSTEM :
- Human Lymphocyte
- DOSE/DURATION :
- 630 umol/L
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 279,75,1992 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 84204 No. of Facilities: 711 (estimated) No. of Industries: 23 No. of Occupations: 28 No. of Employees: 15851 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 84204 No. of Facilities: 15863 (estimated) No. of Industries: 135 No. of Occupations: 89 No. of Employees: 176189 (estimated) No. of Female Employees: 20117 (estimated)
- TYPE OF TEST :
- Sister chromatid exchange
- TEST SYSTEM :
- Human Lymphocyte
- DOSE/DURATION :
- 630 umol/L
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 279,75,1992 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 84204 No. of Facilities: 711 (estimated) No. of Industries: 23 No. of Occupations: 28 No. of Employees: 15851 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 84204 No. of Facilities: 15863 (estimated) No. of Industries: 135 No. of Occupations: 89 No. of Employees: 176189 (estimated) No. of Female Employees: 20117 (estimated)
Safety Information
| Symbol | GHS08 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H361d |
| Precautionary Statements | P280 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn:Harmful |
| Risk Phrases | R63 |
| Safety Phrases | S36/37 |
| RIDADR | UN 3265 8/PG 2 |
| WGK Germany | 1 |
| RTECS | MO7700000 |
| Packaging Group | II |
| Hazard Class | 6.1 |
| HS Code | 29159080 |
Customs
| HS Code | 2915900090 |
|---|---|
| Summary | 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0% |
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Synonyms
| Octanoic Acid |
| 2-ethyl-1-hexanoic acid |
| Hexanoic acid, 2-ethyl- |
| 2-ETHYLHEXOIC ACID |
| 2-ethyl-hexansyra |
| QVY4&2 |
| Ethylhexanoic acid |
| CARBOXYLIC ACID C8 |
| EINECS 205-743-6 |
| 2-Ethylcaproic acid |
| 2-ethylhexanoic |
| 2-Ethylhexanoic acid |
| 2-ethyl-hexanoic acid |
| MFCD00002675 |
| Neodymoctic acid |
| Ethylhexoic acid |
