2-Iodoethanol - ≥98%(GC), stabilized with Copper , CAS No.624-76-0

CAS: 624-76-0 Cat. No.: I137311 分子式: C₂H₅IO 分子量: 171.97 Beilstein Registry Number: 1339 EC番号: 210-861-6

GRADE & PURITY ≥98%(GC), stabilized with Copper

Synonyms

AKOS005146198 | DTXSID3060792 | 2-IODOETHANOL | 2-iodo-ethanol | I0391 | InChI=1/C2H5IO/c3-1-2-4/h4H,1-2H | 2-Indoethanol | iodoethyl alcohol | STL560151 | 2-iodoethan-1-ol | A8634 | Ethanol, 2-iodo- | NSC85227 | NSC-85227 | BRN 1098258 | 2-hydroxyethyl i

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

概要

The standard molar enthalpy of 2-iodoethanol formation has been studied.

2-Iodoethanol is used in the synthesis of the neuroexcitants 3-(carboxymethyl)pyrrolidine-2,4-dicarboxylic acid, α-kainic acid, alpha-isokainic acid and alpha-dihydroallokainic acid.

Specifications

同義語

AKOS005146198 | DTXSID3060792 | 2-IODOETHANOL | 2-iodo-ethanol | I0391 | InChI=1/C2H5IO/c3-1-2-4/h4H,1-2H | 2-Indoethanol | iodoethyl alcohol | STL560151 | 2-iodoethan-1-ol | A8634 | Ethanol, 2-iodo- | NSC85227 | NSC-85227 | BRN 1098258 | 2-hydroxyethyl i

仕様と純度

≥98%(GC), stabilized with Copper

保管条件

Store at 2-8°C,Argon charged

入荷

Wet ice

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥98%(GC)

名前と識別子

• パブケム・シド: 488181588
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/488181588
• カノニカル・スマイル: C(CI)O
• IUPAC Name: 2-iodoethanol
• InChIKey: QSECPQCFCWVBKM-UHFFFAOYSA-N
• INCHI: 1S/C2H5IO/c3-1-2-4/h4H,1-2H2
• 異性体SMILES: C(CI)O
• WGKドイツ: 3
• RTECS: KL3820000
• 分子量: 171.97
• Beilstein: 1339
• Reaxy-Rn: 1098258
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1098258&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • 分類 Halohydrins
      • Subclass Iodohydrins

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• 分類: Halohydrins
• Subclass: Iodohydrins
• Intermediate Tree Nodes: Not available
• Direct Parent: Iodohydrins
• Alternative Parents: Primary alcohols Organoiodides Hydrocarbon derivatives Alkyl iodides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Iodohydrin - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organoiodide - Alkyl iodide - Alkyl halide - Alcohol - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as iodohydrins. These are alcohols substituted by a iodine atom at a saturated carbon atom otherwise bearing only hydrogen or hydrocarbyl groups.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

化学的性質と物理的性質

• 溶解度: Soluble in water.
• 感度: light sensitive;heat sensitive; air sensitive
• 屈折率: 1.572
• 引火点（°F）: 149 °F
• 引火点（°C）: 65°C(lit.)
• 沸点（°C）: 85 °C/25 mmHg
• 分子量: 171.960 g/mol
• XLogP3: 0.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 171.939 Da
• Monoisotopic Mass: 171.939 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 10.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

参考文献

1. Jianxiong Xu, Yuecong Luo, Yin Chen, Ziyu Guo, Yutong Zhang, Shaowen Xie, Na Li, Lijian Xu.  (2022)  Tough, Self-Recoverable, Spiropyran (SP3) Bearing Polymer Beads Incorporated PAM Hydrogels with Sole Mechanochromic Behavior.  Gels,  8  (4): (208).  [PMID:35448109] [10.3390/gels8040208]

2. Fan Chuyao, Deng Qiang, Zhu Ting F..  (2021)  Bioorthogonal information storage in l-DNA with a high-fidelity mirror-image Pfu DNA polymerase.  NATURE BIOTECHNOLOGY,  39  (12): (1548-1555).  [PMID:34326549] [10.1038/s41587-021-00969-6]

3. Jia Tian, Chao Xiao, Baoxuan Huang, Chao Wang, Weian Zhang.  (2019)  Janus macromolecular brushes for synergistic cascade-amplified photodynamic therapy and enhanced chemotherapy.  Acta Biomaterialia,      [PMID:31726248] [10.1016/j.actbio.2019.11.018]

4. Jia Tian, Chao Xiao, Baoxuan Huang, Xiaoze Jiang, Hongliang Cao, Feng Liu, Weian Zhang.  (2019)  Combating Multidrug Resistance through an NIR-Triggered Cyanine-Containing Amphiphilic Block Copolymer.  ACS Applied Bio Materials,      [PMID:35030676] [10.1021/acsabm.8b00793]

5. Jinhao Yan, Haoqi Wang, Xueqin Zhao, Longxiang Tao, Xuefu Wang, Jun Yin.  (2024)  Polymorphic Supramolecular Therapeutic Platforms with Precise Dye/Drug Ratio to Perform Synergistic Chemo-Photo Anti-Tumor Therapy and Long-Term Immune Protection.  Advanced Healthcare Materials,      [PMID:39375970] [10.1002/adhm.202402907]

6. Xu Zijie, Liu Xingyao, Yu Chongwen, Fan Xinyu, Yan Zhongwei, Xiao Haotian, Song Yujie, Xu Jian.  (2025)  Photochromic functionalization of polyetheramine-cured epoxy resin based on spiropyran derivatives doping.  JOURNAL OF POLYMER RESEARCH,  32  (5): (1-14).  [PMID:] [10.1007/s10965-025-04378-0]

よくある質問

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 624-76-0, the molecular formula is C2H5IO, and the molecular weight is 171.97 g/mol. InChIKey QSECPQCFCWVBKM-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.