Isooctane - for spectroscopy, high purity , CAS No.540-84-1

58 Citations
Item Number
I103242
Grouped product items
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I103242-250ml
250ml
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$45.90
I103242-500ml
500ml
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$63.90
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Spectroscopic reagent

Basic Description

Synonyms2,4,4-Trimethylpentane | 2,2,4-Trimethylpentane, HPLC Grade | W-109087 | NSC 39117 | 2,2,4-Trimethylpentane, puriss. p.a., ACS reagent, >=99.5% (GC) | DTXCID104370 | NCGC00258679-01 | CHEBI:62805 | Pentane, 2,2,4-trimethyl- | 2,2,4-Trimethylpentane, ACS r
Specifications & Purityfor spectroscopy
Biochemical and Physiological MechanismsIsooctane 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 InNormal
Gradefor spectroscopy
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)

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19 results found

Lot NumberCertificate TypeDateItem
H2426276Certificate of AnalysisAug 27, 2024 I103242
F2426161Certificate of AnalysisJun 28, 2024 I103242
E2406236Certificate of AnalysisMay 11, 2024 I103242
C2414806Certificate of AnalysisMar 25, 2024 I103242
C2414807Certificate of AnalysisMar 25, 2024 I103242
L2325270Certificate of AnalysisJan 04, 2024 I103242
L2325269Certificate of AnalysisJan 04, 2024 I103242
H2328613Certificate of AnalysisSep 07, 2023 I103242
H2315346Certificate of AnalysisSep 01, 2023 I103242
D2319748Certificate of AnalysisMay 08, 2023 I103242
D2319773Certificate of AnalysisMay 08, 2023 I103242
D2319774Certificate of AnalysisMay 08, 2023 I103242
J2218157Certificate of AnalysisOct 21, 2022 I103242
H2212449Certificate of AnalysisAug 31, 2022 I103242
H2212450Certificate of AnalysisAug 31, 2022 I103242
F2215076Certificate of AnalysisJul 01, 2022 I103242
E2207094Certificate of AnalysisMay 13, 2022 I103242
C2209615Certificate of AnalysisMar 12, 2022 I103242
C2209647Certificate of AnalysisMar 12, 2022 I103242

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Chemical and Physical Properties

SolubilityInsoluble in water; Miscible with Heptane,Acetone; Soluble in Ether,Benzene,Chloroform,Toluene
Refractive Index1.39157
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

Related Documents

Citations of This Product

1. Aiguo Han, Shijie Xu, Xinyu Wang, Haolong Chang, Rongzheng Tian, Xin Zhang, Xing Chen, Dawei Song, Yongan Yang.  (2023)  Toward High-Quality Sulfide Solid Electrolytes: A Liquid-Phase Approach Featured with an Interparticle Coupled Unification Effect.  Small,    (2307997).  [PMID:38148323]
2. Chang-Hua Zhao, Yu-Ping Zhang, Li Wan, Xin-Xin Chen, Pei Yuan, Ling-Bo Qu.  (2023)  Versatile Application of TiO2@PDA Modified Filter Paper for Oily Wastewater Treatment.  MOLECULES,  28  (23): (7903).  [PMID:38067632]
3. Rongrong Zhu, Yan Yuan, Rourou Qi, Jianying Liang, Yan Shi, Hongbo Weng.  (2023)  Quantitative profiling of carboxylic compounds by gas chromatography-mass spectrometry for revealing biomarkers of diabetic kidney disease.  JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES,  1231  (30): (123930).  [PMID:38029665]
4. Yue Liu, Jiajun Zhang, Taimei Cai, Rong Wang, Gan Yang, Tao Wen, Hailong Peng.  (2023)  Magnetic and N–doped nanofibrous carbon microsphere with hierarchical porosity as a nanozyme for on-site and visual detection of glucose.  Journal of the Taiwan Institute of Chemical Engineers,  152  (105171).  [PMID:19398576]
5. Yu-Ping Zhang, Ya-Ning Wang, Li Wan, Xin-Xin Chen, Chang-Hua Zhao.  (2023)  Superwetting Stainless Steel Mesh Used for Both Immiscible Oil/Water and Surfactant-Stabilized Emulsion Separation.  Membranes,  13  (10): (808).  [PMID:37887980]
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7. Xian He, Wanshui Yang, Qihong Zhao, Xinsheng Qin.  (2023)  Controlled oxidation and digestion of Pickering emulsions stabilized by quinoa protein and (-)-epigallocatechin-3-gallate (EGCG) hybrid particles.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,  253  (1): (126755).  [PMID:37678683]
8. Zhengchao Shen, Kexin Tian, Muhammad Mujahid Ali, Sifan Mei, Xin Ma, Jiang Liang, Feng Pan, Jianwen Li, Haixia Sui, Zhenxia Du.  (2023)  The occurrence and probabilistic risk assessment of 3-MCPDEs and GEs in infant formulas from Chinese market employing Monte Carlo simulation technique.  FOOD AND CHEMICAL TOXICOLOGY,  179  (113978).  [PMID:37532171]
9. Yu-Ping Zhang, Ya-Ning Wang, Hong-Li Du, Ling-Bo Qv, Jun Chen.  (2023)  Preparation of Superhydrophilic/Underwater Superoleophobic and Superhydrophobic Stainless Steel Meshes Used for Oil/Water Separation.  Polymers,  15  (14): (3042).  [PMID:37514432]
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42. Zhenyu Wang, Jinyang Li, Fuxi Peng, Hanpeng Deng, Jiayang Li, Wei Wei, Zuowan Zhou.  (2022)  Monolithic robust hybrid sponge with enhanced light adsorption and ultrafast photothermal heating rate for rapid oil cleaning.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,  628  (233).  [PMID:35998449]
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44. Wei Liu, Xiaoxue Mao, Zhiqin Zhou.  (2022)  Analysis of physicochemical properties, fatty acid composition and antioxidant activity of seed oil extracted from 12 citrus materials.  INTERNATIONAL JOURNAL OF FOOD SCIENCE AND TECHNOLOGY,  57  (10): (6480-6491).  [PMID:]
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References

1. Aiguo Han, Shijie Xu, Xinyu Wang, Haolong Chang, Rongzheng Tian, Xin Zhang, Xing Chen, Dawei Song, Yongan Yang.  (2023)  Toward High-Quality Sulfide Solid Electrolytes: A Liquid-Phase Approach Featured with an Interparticle Coupled Unification Effect.  Small,    (2307997).  [PMID:38148323]
2. Chang-Hua Zhao, Yu-Ping Zhang, Li Wan, Xin-Xin Chen, Pei Yuan, Ling-Bo Qu.  (2023)  Versatile Application of TiO2@PDA Modified Filter Paper for Oily Wastewater Treatment.  MOLECULES,  28  (23): (7903).  [PMID:38067632]
3. Rongrong Zhu, Yan Yuan, Rourou Qi, Jianying Liang, Yan Shi, Hongbo Weng.  (2023)  Quantitative profiling of carboxylic compounds by gas chromatography-mass spectrometry for revealing biomarkers of diabetic kidney disease.  JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES,  1231  (30): (123930).  [PMID:38029665]
4. Yue Liu, Jiajun Zhang, Taimei Cai, Rong Wang, Gan Yang, Tao Wen, Hailong Peng.  (2023)  Magnetic and N–doped nanofibrous carbon microsphere with hierarchical porosity as a nanozyme for on-site and visual detection of glucose.  Journal of the Taiwan Institute of Chemical Engineers,  152  (105171).  [PMID:19398576]
5. Yu-Ping Zhang, Ya-Ning Wang, Li Wan, Xin-Xin Chen, Chang-Hua Zhao.  (2023)  Superwetting Stainless Steel Mesh Used for Both Immiscible Oil/Water and Surfactant-Stabilized Emulsion Separation.  Membranes,  13  (10): (808).  [PMID:37887980]
6. Yue Wu, Guangyuan Lu, Ping Xu, Tian C. Zhang, Huaqiang He, Shaojun Yuan.  (2023)  Hierarchical Ni-Mn LDHs@CuC2O4 Nanosheet Arrays-Modified Copper Mesh: A Dual-Functional Material for Enhancing Oil/Water Separation and Supercapacitors.  INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES,  24  (18): (14085).  [PMID:37762387]
7. Xian He, Wanshui Yang, Qihong Zhao, Xinsheng Qin.  (2023)  Controlled oxidation and digestion of Pickering emulsions stabilized by quinoa protein and (-)-epigallocatechin-3-gallate (EGCG) hybrid particles.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,  253  (1): (126755).  [PMID:37678683]
8. Zhengchao Shen, Kexin Tian, Muhammad Mujahid Ali, Sifan Mei, Xin Ma, Jiang Liang, Feng Pan, Jianwen Li, Haixia Sui, Zhenxia Du.  (2023)  The occurrence and probabilistic risk assessment of 3-MCPDEs and GEs in infant formulas from Chinese market employing Monte Carlo simulation technique.  FOOD AND CHEMICAL TOXICOLOGY,  179  (113978).  [PMID:37532171]
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29. Linxi Wang, Zhen Yang, Yutong Liao, Jianhong Luo.  (2023)  Synthesis of reusable and anti-fouling Co-Al-Ce LDHs coated stainless steel mesh for ultrafast oil/water separation and photocatalytic degradation.  APPLIED CLAY SCIENCE,  232  (106769).  [PMID:]
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35. Bing Wang, Xianfeng Luo, Yawei Feng, Linfeng Yang, Chunhui Zhang, Zhichao Dong, Lei Jiang, Haoyu Dai.  (2022)  Turbo-Synergistic Oily Wastewater Remediation in Bio-Inspired Cone Array Barrel.  Advanced Science,  (33): (2204244).  [PMID:36202765]
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Solution Calculators