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Home> Hot Product Listed S   > SCHEMBL9075953
31087-39-5 structure

SCHEMBL9075953

CAS No.:31087-39-5
Molecular Weight:201.30582
Molecular Formula:C19H18N4O2S (isomer)
Names and Identifiers
Synonyms

5-bromo-3-(chloromethyl)-1,2,4-oxadiazole

Inchi
InChI=1/C3H8O.Cr/c1-3(2)4;/h3-4H,1-2H3;/q;+3
Canonical Smiles
CCCN(CCC)CC(C)C(=O)OC
Safety and Handling
Transport
1993
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:201.30582g/mol
  • Molecular Formula:C19H18N4O2S
  • Exact Mass:201.172879
  • Monoisotopic Mass:201.172879
  • Complexity:153
  • Rotatable Bond Count:8
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:29.5
  • Heavy Atom Count:14
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:1
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:1-631-5046093
  • Fax:1-631-6147828
 
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