Isopropyl formate - ≥98% , CAS No.625-55-8

CAS: 625-55-8 Cat. No.: I112304 Fórmula: C₄H₈O₂ Peso molecular: 88.11 Beilstein Registry Number: 2(4)27 Número EC: 210-901-2

GRADE & PURITY ≥98%

Synonyms

Formic Acid Isopropyl Ester | ISOPROPYL FORMATE [HSDB] | NCGC00256945-01 | propan-2-yl methanoate | DTXSID2027258 | FT-0627464 | H1L164W42G | Q461068 | CHEBI:173325 | AKOS015915401 | formic acid propan-2-yl ester | Formic acid, 1-methylethyl ester | propa

Storage

Room temperature,Desiccated

Shipped In

FedEx DG Service

Specifications

Sinónimos

Formic Acid Isopropyl Ester | ISOPROPYL FORMATE [HSDB] | NCGC00256945-01 | propan-2-yl methanoate | DTXSID2027258 | FT-0627464 | H1L164W42G | Q461068 | CHEBI:173325 | AKOS015915401 | formic acid propan-2-yl ester | Formic acid, 1-methylethyl ester | propa

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature,Desiccated

Enviado en

FedEx DG Service

Pureza

≥98%

Nombres e identificadores

Pubchem Sid

504752289

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752289

Sonrisas canónicas

CC(C)OC=O

IUPAC Name

propan-2-yl formate

InChIKey

RMOUBSOVHSONPZ-UHFFFAOYSA-N

INCHI

1S/C4H8O2/c1-4(2)6-3-5/h3-4H,1-2H3

Isómeros SMILES

CC(C)OC=O

WGK Alemania

3

RTECS

LQ8750000

Número ONU

1281

Peso molecular

88.11

Beilstein

2(4)27

Reaxy-Rn

1735844

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1735844&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: 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
• Descripción: 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: 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

Propiedades químicas y físicas

• Índice de refracción: 1.37
• Punto de inflamación (°F): 8.6 °F
• Punto de inflamación (°C): -14°C
• Punto de ebullición (°C): 68-71°C
• Punto de fusión (°C): -93°C
• Peso molecular: 88.110 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 88.0524 Da
• Monoisotopic Mass: 88.0524 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 40.800
• 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

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

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

The CAS Number is 625-55-8, the molecular formula is C4H8O2, and the molecular weight is 88.11 g/mol. InChIKey RMOUBSOVHSONPZ-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.