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1,5-Bis[4-(trifluoromethyl)phenyl]-1,4-pentadien-3-one

Catalog Number
ACM103836711
Product Name
1,5-Bis[4-(trifluoromethyl)phenyl]-1,4-pentadien-3-one
Structure
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CAS
103836-71-1
  • Product Overview
Synonyms
B4468; trans,trans-Bis[4-(trifluoromethyl)benzal]acetone; trans,trans-Bis[4-(trifluoromethyl)benzylidene]acetone; 1,5-Bis[4-(trifluoromethyl)phenyl]-1,4-pentadien-3-one; trans,trans-Bis[4-(trifluoromethyl)styryl] Ketone; ACM42160076; BDBM50265040; (1E,4E)-1,5-Bis[4-(trifluoromethyl)phenyl]-1,4-pentadien-3-one #; (1E,4E)-1,5-bis[4-(trifluoromethyl)phenyl]penta-1,4-dien-3-one; 1,5-Bis(4-trifluoromethylphenyl)-penta-1,4-diene-3-one;
IUPAC Name
(1E,4E)-1,5-bis[4-(trifluoromethyl)phenyl]penta-1,4-dien-3-one;
Molecular Weight
370.294g/mol
Molecular Formula
C19H12F6O;
Canonical SMILES
C1=CC(=CC=C1C=CC(=O)C=CC2=CC=C(C=C2)C(F)(F)F)C(F)(F)F;
InChI
InChI=1S/C19H12F6O/c20-18(21,22)15-7-1-13(2-8-15)5-11-17(26)12-6-14-3-9-16(10-4-14)19(23,24)25/h1-12H/b11-5+,12-6+;
InChI Key
OIUBVYQZMUKRRF-YDWXAUTNSA-N;
Complexity
469
Covalently-Bonded Unit Count
1
Defined Bond Stereocenter Count
2
Exact Mass
370.079g/mol
H-Bond Acceptor
7
Heavy Atom Count
26
Monoisotopic Mass
370.079g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
17.1A^2
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