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13832-89-8 | 2,4,6,10-Dodecatetraenal, 3,7,11-trimethyl-
CAS No: 13832-89-8 Catalog No: AG0018JE MDL No:
Product Description
Catalog Number:
AG0018JE
Chemical Name:
2,4,6,10-Dodecatetraenal, 3,7,11-trimethyl-
CAS Number:
13832-89-8
Molecular Formula:
C15H22O
Molecular Weight:
218.3346
IUPAC Name:
3,7,11-trimethyldodeca-2,4,6,10-tetraenal
InChI:
InChI=1S/C15H22O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h6-7,9-12H,5,8H2,1-4H3
InChI Key:
XXDVGEYVTWJVBB-UHFFFAOYSA-N
SMILES:
O=CC=C(C=CC=C(CCC=C(C)C)C)C
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.167g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.34g/mol
Monoisotopic Mass:
218.167g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3
XLogP3:
4.9
Literature
| Title | Journal |
|---|---|
| Formation of cleavage products by autoxidation of lycopene. | Lipids 20010201 |
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