3-EthoxyBenzaldehyde - ≥97% , CAS No.22924-15-8

CAS: 22924-15-8 Cat. No.: E135710 Formula: C₂H₅OC₆H₄CHO Molecular Weight: 150.17 EC Number: 245-333-4

GRADE & PURITY ≥97%

Synonyms

AKOS000174779 | 3-Ethoxybenzaldehyde, 98% | Benzaldehyde, 3-ethoxy- | FT-0615630 | DTXSID60177469 | MFCD00016606 | STK500955 | W-107449 | SY014535 | Benzaldehyde, m-ethoxy- | E1133 | m-Ethoxybenzaldehyde | Z53836051 | BBL034234 | EINECS 245-333-4 | SCHEMB

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

AKOS000174779 | 3-Ethoxybenzaldehyde, 98% | Benzaldehyde, 3-ethoxy- | FT-0615630 | DTXSID60177469 | MFCD00016606 | STK500955 | W-107449 | SY014535 | Benzaldehyde, m-ethoxy- | E1133 | m-Ethoxybenzaldehyde | Z53836051 | BBL034234 | EINECS 245-333-4 | SCHEMB

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

Pubchem Sid

488186578

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488186578

Canonical Smiles

CCOC1=CC=CC(=C1)C=O

IUPAC Name

3-ethoxybenzaldehyde

InChIKey

QZMGMXBYJZVAJN-UHFFFAOYSA-N

INCHI

1S/C9H10O2/c1-2-11-9-5-3-4-8(6-9)7-10/h3-7H,2H2,1H3

Isomeric SMILES

CCOC1=CC=CC(=C1)C=O

WGK Germany

3

Molecular Weight

150.17

Reaxy-Rn

2083854

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2083854&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Phenol ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Phenol ethers
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenol ethers
• Alternative Parents: Phenoxy compounds Benzoyl derivatives Benzaldehydes Alkyl aryl ethers Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Phenol ether - Benzoyl - Benzaldehyde - Aryl-aldehyde - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
• 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

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Air Sensitive
• Refractive Index: 1.542
• Flash Point(°F): >230 °F
• Flash Point(°C): 110°C
• Boil Point(°C): 243 °C
• Molecular Weight: 150.170 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 150.068 Da
• Monoisotopic Mass: 150.068 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 123.000
• 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

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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 22924-15-8, the molecular formula is C9H10O2, and the molecular weight is 150.17 g/mol. InChIKey QZMGMXBYJZVAJN-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.