2,5-ジメチルヘキサン - ≥98%以上(GC) , CAS No.592-13-2

CAS: 592-13-2 Cat. No.: D155219 分子式: C8H18 分子量: 114.23 Beilstein Registry Number: 1696880 EC番号: 209-745-8
注文可能
GRADE & PURITY ≥98%(GC)
Synonyms
FT-0624981 | 2,5-ジメチルヘキサン, 99% | UNII-PCS13D63P8 | AS-81291 | EINECS 209-745-8 | DTXSID4073201 | NSC 74172 | Biisobutyl | Hexane、2,5-ジメチル|InChI=1/C8H18/c1-7(2)5-6-8(3)4/h7-8H,5-6H2,1-4H|2,5-DIMETHYL HEXANE|D1226|D89815|AKOS015841746
Storage
Room temperature
Shipped In
ノーマル
Size
USA
ドイツ (EU)*
Price
Qty
5ml
D155219-5ml
在庫あり ≥10

$129.90

$152.90
保存 $23.00 (15.04%)
25ml
D155219-25ml
2 在庫あり

$503.90

$653.90
保存 $150.00 (22.94%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%以上(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships ノーマル Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

概要

2,5-ジメチルヘキサンを用いて、分子シミュレーションによる運動特性の解析のための過剰エントロピーのスケーリング関係を研究した。

Specifications

同義語
FT-0624981 | 2,5-ジメチルヘキサン, 99% | UNII-PCS13D63P8 | AS-81291 | EINECS 209-745-8 | DTXSID4073201 | NSC 74172 | Biisobutyl | Hexane、2,5-ジメチル|InChI=1/C8H18/c1-7(2)5-6-8(3)4/h7-8H,5-6H2,1-4H|2,5-DIMETHYL HEXANE|D1226|D89815|AKOS015841746
仕様と純度
≥98%以上(GC)
保管条件
Room temperature
入荷
ノーマル
純度
≥98%(GC)
名前と識別子
パブケム・シド488181389
カノニカル・スマイルCC(C)CCC(C)C
IUPAC Name2,5-dimethylhexane
InChIKeyUWNADWZGEHDQAB-UHFFFAOYSA-N
INCHI1S/C8H18/c1-7(2)5-6-8(3)4/h7-8H,5-6H2,1-4H3
異性体SMILES CC(C)CCC(C)C
WGKドイツ 2
分子量 114.23
Beilstein 1696880
Reaxy-Rn 1696877
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1696877&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassHydrocarbons
分類Saturated hydrocarbons
SubclassAlkanes
Intermediate Tree Nodes Not available
Direct ParentBranched alkanes
Alternative Parents Not available
Molecular FrameworkAliphatic acyclic compounds
Substituents Branched alkane - Aliphatic acyclic compound
説明This compound belongs to the class of organic compounds known as branched alkanes. These are acyclic branched hydrocarbons having the general formula CnH2n+2.
External Descriptors Not available
3 D構造
インタラクティブ化学構造モデル





証明書(CoA、COO、BSE/TSEと分析図)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot NumberCertificate Type日付商品
K2201274Certificate of AnalysisAug 03, 2026 D155219
K2201817Certificate of AnalysisAug 03, 2026 D155219
L2117314Certificate of AnalysisOct 11, 2025 D155219
D2307375Certificate of AnalysisOct 12, 2022 D155219
化学的性質と物理的性質
屈折率1.3910-1.3940
引火点(°F)78.8 °F
引火点(°C)26 °C
沸点(°C)107-108℃
分子量114.230 g/mol
XLogP34.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count3
Exact Mass114.141 Da
Monoisotopic Mass114.141 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count8
Formal Charge0
Complexity36.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
参考文献
1. Wenna Liu, Wanglu Jia, Qiang Wang, Jian Chen, Jinbu Li, Ping’an Peng.  (2024)  Influencing factors of hydrogen isotopic fractionation of light hydrocarbons during evaporation and implications.  ORGANIC GEOCHEMISTRY,      [PMID:] [10.1016/j.orggeochem.2024.104894]
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