Determine the necessary mass, volume, or concentration for preparing a solution.
Basic Description
| Synonyms | 2,2,4-Trimethylpentane|Isooctane|540-84-1|Pentane, 2,2,4-trimethyl-|Isobutyltrimethylmethane|ISO-OCTANE|2,4,4-Trimethylpentane|i-octane|(CH3)2CHCH2C(CH3)3|Isooctane Blank|QAB8F5669O|DTXSID7024370|CHEBI:62805|NSC-39117|MFCD00008943|HSDB 5682|EINECS 208-759 |
|---|---|
| Specifications & Purity | Standard for GC, ≥99.5%(GC) |
| Biochemical and Physiological Mechanisms | Isooctane is an isomer of octane and the standard for the 100 point in octane rating. The compound has also been used to screen for genes that make S. cerivisiae isooctane tolerant and to study their behavior. |
| Shipped In | Normal |
| Grade | Standard for GC |
| Product Description | A hydrocarbon isomer of octane. |
Names and Identifiers
| IUPAC Name | 2,2,4-trimethylpentane |
|---|---|
| INCHI | InChI=1S/C8H18/c1-7(2)6-8(3,4)5/h7H,6H2,1-5H3 |
| InChi Key | NHTMVDHEPJAVLT-UHFFFAOYSA-N |
| Canonical SMILES | CC(C)CC(C)(C)C |
| Isomeric SMILES | CC(C)CC(C)(C)C |
| WGK Germany | 2 |
| RTECS | SA3320000 |
| PubChem CID | 10907 |
| UN Number | 1262 |
| Packing Group | II |
| Molecular Weight | 114.23 |
| Beilstein | 1696876 |
Certificates
Certificate of Analysis(COA)
Enter Lot Number to search for COA:
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| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 D2319764 | Certificate of Analysis | May 08, 2023 | I103236 |
| G2114321 | Certificate of Analysis | Apr 18, 2023 | I103236 |
| D1926070 | Certificate of Analysis | Nov 10, 2022 | I103236 |
Chemical and Physical Properties
| Refractive Index | 1.39157 |
|---|---|
| Flash Point(°C) | -12℃ |
| Boil Point(°C) | 99.3°C |
| Melt Point(°C) | -107.4°C |
Safety and Hazards(GHS)
| Pictogram(s) | GHS08, GHS09, GHS07, GHS02 |
|---|---|
| Signal | Danger |
| Hazard Statements | H315:Causes skin irritation H225:Highly Flammable liquid and vapor H336:May cause drowsiness or dizziness H400:Very toxic to aquatic life H410:Very toxic to aquatic life with long lasting effects H304:May be fatal if swallowed and enters airways |
| Precautionary Statements | P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P378:In case of fire: Use ... to extinguish. P210:Keep away from heat, hot surface, sparks, open flames and other ignition sources. - No smoking. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P233:Keep container tightly closed. P240:Ground/bond container and receiving equipment. P264:Wash hands [and …] thoroughly after handling. P403+P235:Store in a well-ventilated place. Keep cool. P303+P361+P353:IF ON SKIN (or hair): Take off Immediately all contaminated clothing. Rinse SKIN with water [or shower]. P271:Use only outdoors or in a well-ventilated area. P241:Use explosion-proof [electrical/ventilating/lighting/.../] equipment. P331:Do NOT induce vomiting. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P391:Collect spillage. P242:Use only non-sparking tools. P243:Take precautionary measures against static discharge. P301+P316:IF SWALLOWED: Get emergency medical help immediately. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell. |
| WGK Germany | 2 |
| RTECS | SA3320000 |
| Class | 3 |
| Merck Index | 5193 |