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Home> Hot Product Listed 1   > 1,3,4-Oxadiazole,2-[1,1'-biphenyl]-4-yl-5-(4-methylphenyl)-
152457-95-9 structure

1,3,4-Oxadiazole,2-[1,1'-biphenyl]-4-yl-5-(4-methylphenyl)-

Iupac Name:2,5-bis(2,2,2-trifluoroethoxy)benzenesulfonyl chloride
CAS No.:152457-95-9
Molecular Weight:372.662
Molecular Formula:C8H16O (isomer)
Names and Identifiers
Synonyms

1,3,4-Oxadiazole,2-(4-biphenylyl)-5-p-tolyl- (8CI) 2-(4-Biphenylyl)-5-(4-methylphenyl)-1,3,4-oxadiazole 2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole AC1LU6M8 AKOS003575223 HE136303 mPBD SCHEMBL10038533

Inchi
InChI=1S/C10H7ClF6O4S/c11-22(18,19)8-3-6(20-4-9(12,13)14)1-2-7(8)21-5-10(15,16)17/h1-3H,4-5H2
InChkey
UCHAULDYIPVTOP-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=C(C=C1OCC(F)(F)F)S(=O)(=O)Cl)OCC(F)(F)F
Properties
Density
1.161
Melting Point
48-52°C
Boiling Point
382.3°Cat760mmHg
Vapour
7.78E-05mmHg at 25°C
Refractive Index
1.439
Flash Point
222.8°C
Safety and Handling
Risk Statements
R34
Safety Statements
26-36/37/39
HazardClass
CORROSIVE
Reach Info
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:372.662g/mol
  • Molecular Formula:C8H16O
  • Compound Is Canonicalized:True
  • Exact Mass:371.966
  • Monoisotopic Mass:371.966
  • Complexity:458
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:10
  • Topological Polar Surface Area:61A^2
  • Heavy Atom Count:22
  • 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: AAADcYBwOcBEAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGwQAAAAACASg0BIwB4AABAKA ACBCAHBCCAAgIAAIiBoGCIgMJiKEMRqCOCCkwBEIqAfAQAAAAQAABAAAIAACAAAIAABAAAAAAAAA AA==
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