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Home> Hot Product Listed T   > Tetradecanal,12-methyl-
79669-90-2 structure

Tetradecanal,12-methyl-

Iupac Name:methyl 11-hydroxy-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylate
CAS No.:79669-90-2
Molecular Weight:270.284
Molecular Formula:C10F16 (isomer)
Names and Identifiers
Synonyms

12-methyltetradecanal AC1Q2S8U LP109336 SCHEMBL384480 tetradecanal, 12-methyl-

Inchi
InChI=1S/C16H14O4/c1-19-16(18)10-6-7-14-13(8-10)15(17)12-5-3-2-4-11(12)9-20-14/h2-8,15,17H,9H2,1H3
InChkey
NLBXYUUHUFAZDL-UHFFFAOYSA-N
Canonical Smiles
COC(=O)C1=CC2=C(C=C1)OCC3=CC=CC=C3C2O
Properties
Density
1.241
Boiling Point
°Cat760mmHg
Flash Point
°C
Computational chemical data
  • Molecular Weight:270.284g/mol
  • Molecular Formula:C10F16
  • Compound Is Canonicalized:True
  • Exact Mass:270.089
  • Monoisotopic Mass:270.089
  • Complexity:356
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Heavy Atom Count:20
  • 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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