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Home> Encyclopedia > Hot Product Listed 2   > 2,6,10,14,18,22,26,30,34,38,42,46-Octatetracontadodecaen-1-ol,3,7,11,15,19,23,27,31,35,39,43,47-dode...
478046-88-7 structure

2,6,10,14,18,22,26,30,34,38,42,46-Octatetracontadodecaen-1-ol,3,7,11,15,19,23,27,31,35,39,43,47-dodecamethyl-, dihydrogen phosphate,diammonium salt, (2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34Z,38Z,42Z)- (9CI)

Iupac Name:(3-methoxy-3-oxoprop-1-enyl) 4-tert-butylbenzoate
CAS No.:478046-88-7
Molecular Weight:262.305
Molecular Formula:C14H16N2 (isomer)
Names and Identifiers
Synonyms

2,6,10,14,18,22,26,30,34,38,42,46-Octatetracontadodecaen-1-ol,3,7,11,15,19,23,27,31,35,39,43,47-dodecamethyl-, dihydrogen phosphate,diammonium salt, (all-Z)- 2,6,10,14,18,22,26,30,34,38,42,46-octatetracontadodecaen-1-ol,3,7,11,15,19,23,27,31,35,39,43,47-dodecamethyl-,dihydrogen phosphate,diammonium salt,(2z,6z,10z,14z,18z,22z,26z,30z,34z,38z,42z)-(9ci)

Inchi
InChI=1S/C15H18O4/c1-15(2,3)12-7-5-11(6-8-12)14(17)19-10-9-13(16)18-4/h5-10H,1-4H3
InChkey
ASCNMNUWBMJGOW-UHFFFAOYSA-N
Canonical Smiles
CC(C)(C)C1=CC=C(C=C1)C(=O)OC=CC(=O)OC
Properties
Density
1.065
Flash Point
105.1°C
Computational chemical data
  • Molecular Weight:262.305g/mol
  • Molecular Formula:C14H16N2
  • Compound Is Canonicalized:True
  • Exact Mass:262.121
  • Monoisotopic Mass:262.121
  • Complexity:344
  • Rotatable Bond Count:6
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:4
  • Heavy Atom Count:19
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:1
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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