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15130-76-4 | 2,6,10-Dodecatriene, 1-methoxy-3,7,11-trimethyl-
CAS No: 15130-76-4 Catalog No: AG001N9E MDL No:
Product Description
Catalog Number:
AG001N9E
Chemical Name:
2,6,10-Dodecatriene, 1-methoxy-3,7,11-trimethyl-
CAS Number:
15130-76-4
Molecular Formula:
C16H28O
Molecular Weight:
236.3929
IUPAC Name:
1-methoxy-3,7,11-trimethyldodeca-2,6,10-triene
InChI:
InChI=1S/C16H28O/c1-14(2)8-6-9-15(3)10-7-11-16(4)12-13-17-5/h8,10,12H,6-7,9,11,13H2,1-5H3
InChI Key:
HZDZRGKULMGCJE-UHFFFAOYSA-N
SMILES:
COCC=C(CCC=C(CCC=C(C)C)C)C
EC Number:
239-193-3
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.214g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.399g/mol
Monoisotopic Mass:
236.214g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
5.3
Literature
| Title | Journal |
|---|---|
| Identification of pheromones and optimization of bait composition for click beetle pests (Coleoptera: Elateridae) in Central and Western Europe. | Pest management science 20030401 |
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