Introduction：Basic information about CAS 13403-01-5|2-(2,4-Di-tert-pentylphenoxy)butryic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-(2,4-Di-tert-pentylphenoxy)butryic acid |
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| CAS Number | 13403-01-5 | Molecular Weight | 320.46600 |
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| Density | 0.988 g/cm3 | Boiling Point | 414.9ºC at 760 mmHg |
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| Molecular Formula | C20H32O3 | Melting Point | 76-78ºC |
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| MSDS | / | Flash Point | 134.2ºC |
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Names
| Name | 2-(2,4-Di-tert-pentylphenoxy)butanoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.988 g/cm3 |
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| Boiling Point | 414.9ºC at 760 mmHg |
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| Melting Point | 76-78ºC |
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| Molecular Formula | C20H32O3 |
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| Molecular Weight | 320.46600 |
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| Flash Point | 134.2ºC |
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| Exact Mass | 320.23500 |
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| PSA | 46.53000 |
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| LogP | 5.30380 |
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| Vapour Pressure | 1.25E-07mmHg at 25°C |
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| Index of Refraction | 1.493 |
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| InChIKey | PHCYXPLSQNMCRY-UHFFFAOYSA-N |
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| SMILES | CCC(Oc1ccc(C(C)(C)CC)cc1C(C)(C)CC)C(=O)O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- ET0600000
- CHEMICAL NAME :
- Butyric acid, 2-(2,4-di-tert-pentylphenoxy)-
- CAS REGISTRY NUMBER :
- 13403-01-5
- LAST UPDATED :
- 199707
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C20-H32-O3
- MOLECULAR WEIGHT :
- 320.52
- WISWESSER LINE NOTATION :
- QVY2&OR B1X1&1&1 D1X1&1&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >3200 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- KODAK* Kodak Company Reports. (343 State St., Rochester, NY 14650) Volume(issue)/page/year: 21MAY1971
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 400 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- KODAK* Kodak Company Reports. (343 State St., Rochester, NY 14650) Volume(issue)/page/year: 21MAY1971
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - guinea pig
- DOSE/DURATION :
- >20 mL/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- KODAK* Kodak Company Reports. (343 State St., Rochester, NY 14650) Volume(issue)/page/year: 21MAY1971
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Safety Information
Customs
| HS Code | 2918990090 |
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| Summary | 2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| MFCD00045895 |
| 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoic acid |
| EINECS 236-495-7 |
