Introduction：Basic information about CAS 38861-88-0|4-Isobutylbenzoicacid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-Isobutylbenzoicacid |
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| CAS Number | 38861-88-0 | Molecular Weight | 178.228 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 293.1±19.0 °C at 760 mmHg |
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| Molecular Formula | C11H14O2 | Melting Point | 144°C |
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| MSDS | / | Flash Point | 138.8±16.2 °C |
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Names
| Name | 4-Isobutylbenzoic Acid |
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| Synonym | More Synonyms |
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4-Isobutylbenzoicacid BiologicalActivity
| Description | 4-Isobutylbenzoic acid is an intermediate in the synthesis of compounds[1]. |
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| Related Catalog | Research Areas >>OthersSignaling Pathways >>Others >>Others |
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| References | [1]. V. Beghetto, et al. Synthesis of 4-Isobutylbenzaldehyde an Important |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 293.1±19.0 °C at 760 mmHg |
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| Melting Point | 144°C |
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| Molecular Formula | C11H14O2 |
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| Molecular Weight | 178.228 |
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| Flash Point | 138.8±16.2 °C |
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| Exact Mass | 178.099380 |
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| PSA | 37.30000 |
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| LogP | 3.77 |
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| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
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| Index of Refraction | 1.530 |
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| InChIKey | VUBBCFWWSKOHTH-UHFFFAOYSA-N |
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| SMILES | CC(C)Cc1ccc(C(=O)O)cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DH3073800
- CHEMICAL NAME :
- Benzoic acid, p-isobutyl-
- CAS REGISTRY NUMBER :
- 38861-88-0
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C11-H14-O2
- MOLECULAR WEIGHT :
- 178.25
- WISWESSER LINE NOTATION :
- QVR D1Y1&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 56 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#10075
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Safety Information
| Hazard Codes | Xi |
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| RTECS | DH3073800 |
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| HS Code | 2916399090 |
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Customs
| HS Code | 2916399090 |
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| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| MFCD00191658 |
| 4-Isobutylbenzoic acid |
| Benzoic acid, 4-(2-methylpropyl)- |
| 4-Isobutylbenzoicacid |
| 4-(2-methylpropyl)benzoic acid |
