2,5-Dibromo-N-(2-ethylhexyl)-3,4-thiophenedicarboximide
Catalog Number
ACM1231160830-1
CAS
1231160-83-0
IUPAC Name
1,3-dibromo-5-(2-ethylhexyl)thieno[3,4-c]pyrrole-4,6-dione
Synonyms
1,3-Dibromo-5-(2-ethylhexyl)-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione
Molecular Weight
423.16
Molecular Formula
C14H17Br2NO2S
Product Information
Canonical SMILES
CCCCC(CC)CN1C(=O)C2=C(SC(=C2C1=O)Br)Br
InChI
InChI=1S/C14H17Br2NO2S/c1-3-5-6-8(4-2)7-17-13(18)9-10(14(17)19)12(16)20-11(9)15/h8H,3-7H2,1-2H3
InChI Key
AOZLCBYWDXFKCJ-UHFFFAOYSA-N
Melting Point
112 °C
Purity
>98.0%(GC)
Appearance
White to Yellow to Orange powder to crystal
Complexity
367
Exact Mass
422.93263g/mol
Hazard Statements
H413 : May cause long lasting harmful effects to aquatic life.
Heavy Atom Count
20
MDL Number
MFCD23703120
Monoisotopic Mass
420.93468g/mol
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P273 : Avoid release to the environment.
Reaxys Registry Number
20611200
Rotatable Bond Count
6
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