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30361-28-5 | 2,4-Octadienal, (2E,4E)-
CAS No: 30361-28-5 Catalog No: AG002ZV3 MDL No:MFCD00014676
Product Description
Catalog Number:
AG002ZV3
Chemical Name:
2,4-Octadienal, (2E,4E)-
CAS Number:
30361-28-5
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
MDL Number:
MFCD00014676
IUPAC Name:
(2E,4E)-octa-2,4-dienal
InChI:
InChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h4-8H,2-3H2,1H3/b5-4+,7-6+
InChI Key:
DVVATNQISMINCX-YTXTXJHMSA-N
SMILES:
CCC/C=C/C=C/C=O
EC Number:
250-147-1
UNII:
PR4J26TQJD
FEMA Number:
3721
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
124.089g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.183g/mol
Monoisotopic Mass:
124.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Dynamics of dissolved and particulate polyunsaturated aldehydes in mesocosms inoculated with different densities of the diatom Skeletonema marinoi. | Marine drugs 20110101 |
| Differential effect of three polyunsaturated aldehydes on marine bacterial isolates. | Aquatic toxicology (Amsterdam, Netherlands) 20080131 |
| Biosynthetic intermediates and stereochemical aspects of aldehyde biosynthesis in the marine diatom Thalassiosira rotula. | Phytochemistry 20060201 |
| Production of octadienal in the marine diatom Skeletonema costatum. | Organic letters 20030320 |
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