3-Ethoxy-1,2-propanediol - ≥98% , CAS No.1874-62-0

CAS: 1874-62-0 Cat. No.: E305267 Formule: C₅H₁₂O₃ Poids moléculaire: 120.15 Numéro CE: 217-503-8

GRADE & PURITY ≥98%

Synonyms

1,2-Propanediol, 3-ethoxy- | DTXSID10870918 | AS-58089 | SCHEMBL33689 | 3-Ethoxy-2-propanediol | AMY318 | NSC227880 | NSC-227880 | MLS000573782 | N,N-Dimethyl-4-[(E)-2-(4-nitrophenyl)ethenyl]aniline | AKOS008105075 | 3-Ethoxy-1,2-propanediol, 98% | alpha-

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Synonymes

1,2-Propanediol, 3-ethoxy- | DTXSID10870918 | AS-58089 | SCHEMBL33689 | 3-Ethoxy-2-propanediol | AMY318 | NSC227880 | NSC-227880 | MLS000573782 | N,N-Dimethyl-4-[(E)-2-(4-nitrophenyl)ethenyl]aniline | AKOS008105075 | 3-Ethoxy-1,2-propanediol, 98% | alpha-

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature,Desiccated

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

Pubchem Sid

504756206

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504756206

Sourires canoniques

CCOCC(CO)O

IUPAC Name

3-ethoxypropane-1,2-diol

InChIKey

LOSWWGJGSSQDKH-UHFFFAOYSA-N

INCHI

1S/C5H12O3/c1-2-8-4-5(7)3-6/h5-7H,2-4H2,1H3

Isomères SMILES

CCOCC(CO)O

Poids moléculaire

120.15

Reaxy-Rn

1734312

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1734312&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Glycerolipids
      • Subclass Monoradylglycerols

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Glycerolipids
• Subclass: Monoradylglycerols
• Intermediate Tree Nodes: Not available
• Direct Parent: Monoalkylglycerols
• Alternative Parents: 1-O-alkylglycerols Glycerol ethers Secondary alcohols 1,2-diols Dialkyl ethers Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Monoalkylglycerol - 1-o-alkylglycerol - Glycerol ether - Secondary alcohol - 1,2-diol - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as monoalkylglycerols. These are glycerolipids containing exactly one aliphatic chain linked to the glycerol moiety. This chain is the only one linked to the glycerol.
• 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

Propriétés chimiques et physiques

• Sensibilité: Hygroscopic
• Indice de réfraction: n20/D 1.441 (lit.)
• Point d'éclair (°C): 99.5ºC
• Point d'ébullition (°C): 222 °C (lit.)
• Poids moléculaire: 120.150 g/mol
• XLogP3: -0.900
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 120.079 Da
• Monoisotopic Mass: 120.079 Da
• Topological Polar Surface Area: 49.700 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 46.900
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Foire aux questions

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 ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 1874-62-0, the molecular formula is C5H12O3, and the molecular weight is 120.15 g/mol. InChIKey LOSWWGJGSSQDKH-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.