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Home> Hot Product Listed 1   > 1-(4-bromo-2-ethylphenyl)-1h-pyrrole-2,5-dione
37399-09-0 structure

1-(4-bromo-2-ethylphenyl)-1h-pyrrole-2,5-dione

CAS No.:37399-09-0
Molecular Weight:152.19000
Molecular Formula:C13H16N4O2S (isomer)
Names and Identifiers
Synonyms

1-(4-bromo-2-ethylphenyl)pyrrole-2,5-dione AC1LGM2G AK541934 AKOS000304348 bc2054663 en300-227743 MOLPORT-000-161-323 SBB019660 STK060268 ZINC301645

Inchi
InChI=1S/C9H12O2/c10-9(11)8-6-4-1-2-5(3-4)7(6)8/h4-8H,1-3H2,(H,10,11)
InChkey
VKCZTBCHTNDVEK-UHFFFAOYSA-N
Canonical Smiles
C1CC2CC1C3C2C3C(=O)O
Properties
Refractive Index
1.587
HS Code
2916209090
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:152.19000g/mol
  • Molecular Formula:C13H16N4O2S
  • Compound Is Canonicalized:True
  • Exact Mass:152.084
  • Monoisotopic Mass:152.084
  • Complexity:208
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:2
  • Heavy Atom Count:11
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:4
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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