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Home> Encyclopedia > Hot Product Listed E   > Ethyl 2-(2-bromo-6-formylphenoxy)acetate
1187385-79-0 structure

Ethyl 2-(2-bromo-6-formylphenoxy)acetate

Iupac Name:ethyl 2-(2-bromo-6-formylphenoxy)acetate
CAS No.:1187385-79-0
Molecular Weight:287.109
Molecular Formula:C11H11BrO4 (isomer)
Names and Identifiers
Synonyms

A-5267 AJ-96215 AK130720 AKOS010650607 ANW-17180 AX8251643 BG01579511 BG01579512 CTK4B0829 DTXSID10675187 ethyl (2-bromo-6-formylphenoxy)acetate ethyl2-(2-bromo-6-formylphenoxy)acetate KB-50736 mfcd12546512 OR207573 TR-034246 ZINC38537726

Inchi
InChI=1S/C11H11BrO4/c1-2-15-10(14)7-16-11-8(6-13)4-3-5-9(11)12/h3-6H,2,7H2,1H3
InChkey
OKJVUEOWSJELCG-UHFFFAOYSA-N
Canonical Smiles
CCOC(=O)COC1=C(C=CC=C1Br)C=O
Properties
HS Code
2918990090
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:287.109g/mol
  • Molecular Formula:C11H11BrO4
  • Compound Is Canonicalized:True
  • Exact Mass:285.984
  • Monoisotopic Mass:285.984
  • Complexity:244
  • Rotatable Bond Count:6
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:52.6A^2
  • Heavy Atom Count:16
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccBwOAAAEAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGgBAAAABrASgmAIyDoAABACI AijSiAICCAAkIAQIiAFECOgNJjaENR6COWCk4BEKq5eIyCCOAAAAEAAIBAAAAAAgABAIAAAAAAAA AA==
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