4-Pentylbenzoic acid
4-Pentylbenzoic acid
CAS: 26311-45-5
Molecular Formula: C12H16O2
4-Pentylbenzoic acid - Names and Identifiers
| Name | 4-Pentylbenzoic acid |
| Synonyms | 4-pentylbenzoate p-amylbenzoicacid p-Amylbenzoic acid 4-pentyl-benzoicaci 4-Pentylbenzoic acid 4-n-Amylbenzoic acid P-Pentyl Benzoic Acid para-Pentylbenzoic acid Benzoic acid, 4-pentyl- Benzoic acid, p-pentyl- 4-pentylcyclohexanecarboxylate trans-4-broMo-4'-(4-propylcyclohexyl)biphenyl |
| CAS | 26311-45-5 |
| EINECS | 247-607-9 |
| InChI | InChI=1/C12H22O2/c1-2-3-4-5-10-6-8-11(9-7-10)12(13)14/h10-11H,2-9H2,1H3,(H,13,14)/p-1 |
| InChIKey | CWYNKKGQJYAHQG-UHFFFAOYSA-N |
4-Pentylbenzoic acid - Physico-chemical Properties
| Molecular Formula | C12H16O2 |
| Molar Mass | 192.25 |
| Density | 1.0430 |
| Melting Point | 85-90 °C |
| Boling Point | 261 °C (746 mmHg) |
| Flash Point | 147.3°C |
| Water Solubility | insoluble |
| Solubility | Solubility in water: insoluble Solubility in other solvents: miscible with alcohol and e |
| Vapor Presure | 0.000198mmHg at 25°C |
| Appearance | White crystalline powder |
| Color | Colorless liquid |
| BRN | 2044798 |
| pKa | 4.35±0.10(Predicted) |
| Storage Condition | Sealed in dry,Room Temperature |
| Refractive Index | 1.5207 (estimate) |
| MDL | MFCD00002572 |
| Physical and Chemical Properties | Boiling Point: 260.7 at 746mm Hg
|
| Use | Used as a liquid crystal Intermediate |
4-Pentylbenzoic acid - Risk and Safety
| Hazard Symbols | Xi - Irritant |
| Risk Codes | 36/37/38 - Irritating to eyes, respiratory system and skin. |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36 - Wear suitable protective clothing. |
| WGK Germany | 3 |
| RTECS | DH6273000 |
| TSCA | Yes |
| HS Code | 29163990 |
| Toxicity | LD50 ivn-mus: 56 mg/kg CSLNX* NX#10073 CONSENSUS REPORTS: Reported in EPA TSCA |
4-Pentylbenzoic acid - Upstream Downstream Industry
| Raw Materials | Oxygen |
4-Pentylbenzoic acid - Reference Information
| NIST chemical information | Information provided by: webbook.nist.gov (external link) |
| EPA chemical information | Information provided by: ofmpub.epa.gov (external link) |
| use | 4-n-pentylbenzoic acid is used as liquid crystal intermediate, pharmaceutical intermediate, etc. Used as liquid crystal intermediate |
Last Update：2024-04-09 02:00:07
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Raw Materials for 4-Pentylbenzoic acid