Ethyl formate - analytical standard, ≥99.5%(GC) , CAS No.109-94-4

CAS: 109-94-4 Cat. No.: E110412 分子式: C₃H₆O₂ 分子量: 74.08 Beilstein Registry Number: 906769 EC番号: 203-721-0

グレード＆純度 Analytical standard, ≥99.5%(GC)

Synonyms

ETHYL FORMATE [FHFI]|Mrowczan etylu [Polish]|ETHYL FORMATE|Formic acid, ethyl ester|FORMIC ACID,ETHYL ESTER|Ethyle (formiate d')|Etile (formiato di) [Italian]|FEMA NUMBER 2434.|Areginal|ETHYL FORMATE [HSDB]|ETHYL FORMATE [USP-RS]|Ethyl ester of formic acid|Ethyle (formiate d') [French]|Ethyl methanoate|ethylformiat|ethyl format|METHANOIC ACID ETHYL ESTER|Ethylester kyseliny mravenci|Ethyl formate (natural)|Ethyle(formiate d')|EtOCHO|Mrowczan etylu|ETHOXYCARBONYL GROUP|ETHYL FORMATE [FCC]|Formic ether|Ethyl formic ester|Ethylformic ester|Etile (formiato di)|HCOOEt|ETHYL FORMATE (DOT)|Etile(formiato di)|ETHYL FORMATE (USP-RS)|Ethylformiaat|FEMA Number 2434|Aethylformiat [German]|Formic acid ethyl ester|Ethylester kyseliny mravenci [Czech]|Ethyl formate [UN1190] [Flammable liquid]|Carboxylic acid oxaethane

Storage

Room temperature,Desiccated

Shipped In

FedEx DG Service

仕様

同義語

ETHYL FORMATE [FHFI] | Mrowczan etylu [Polish] | ETHYL FORMATE | Formic acid, ethyl ester | FORMIC ACID,ETHYL ESTER | Ethyle (formiate d') | Etile (formiato di) [Italian] | FEMA NUMBER 2434. | Areginal | ETHYL FORMATE [HSDB] | ETHYL FORMATE [USP-RS] | Ethyl ester of formic acid | Ethyle (formiate d') [French] | Ethyl methanoate | ethylfor もっと見る

仕様と純度

analytical standard, ≥99.5%(GC)

保管条件

Room temperature,Desiccated

入荷

FedEx DG Service

等級

分析用標準物質

純度

≥99.5%(GC)

名前と識別子

パブケム・シド

508814977

カノニカル・スマイル

CCOC=O

IUPAC Name

ethyl formate

InChIKey

WBJINCZRORDGAQ-UHFFFAOYSA-N

INCHI

1S/C3H6O2/c1-2-5-3-4/h3H,2H2,1H3

異性体SMILES

CCOC=O

WGKドイツ

1

RTECS

LQ8400000

UN番号

1190

包装グループ

II

分子量

74.08

Beilstein

906769

Reaxy-Rn

906769

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=906769&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 分類 Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 分類: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxylic acid esters
• Alternative Parents: Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group).
• External Descriptors: ethyl ester - formate ester

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

関連ターゲット（人間）

ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

Discover Target: ALDH1A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

作用メカニズム

化学的性質と物理的性質

• 溶解度: Soluble in water (105 g/l at 20 °C).
• 感度: Moisture Sensitive
• 屈折率: 1.359
• 引火点（°F）: -4.0 °F - closed cup
• 引火点（°C）: -20℃
• 沸点（°C）: 54°C
• 融点（°C）: -80°C
• 分子量: 74.080 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 74.0368 Da
• Monoisotopic Mass: 74.0368 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 26.100
• 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