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Trans-2-Dodecenal

CAT: 0024-sc-486245ASize: 1 KgDry Ice: NoHazardous: No
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CAT#:0024-sc-486245ASize:1 Kg
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CAS Number
20407-84-5

Chemical Information

2-Dodecenal

(E)-dodec-2-enal is a trans-2,3-unsaturated fatty aldehyde that is (E)-dodec-2-ene in which the allylic methyl group has been oxidised to the corresponding aldehyde. It has a role as an antibacterial agent, an anthelminthic drug and a plant metabolite. It is a long-chain fatty aldehyde and a trans-2,3-unsaturated fatty aldehyde. It derives from a hydride of an (E)-2-dodecene.

CAS Number20407-84-5
PubChem CID5283361
IUPAC Name(E)-dodec-2-enal
Molecular FormulaC12H22O
Molecular Weight182.30
XLogP4.8
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count9
Heavy Atom Count13
Formal Charge0
Complexity127
SMILES
CCCCCCCCC/C=C/C=O
InChI
InChI=1S/C12H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h10-12H,2-9H2,1H3/b11-10+
InChIKey
SSNZFFBDIMUILS-ZHACJKMWSA-N
Chemical Structure
2D Structure
2D structure of 2-Dodecenal
CAS: 20407-84-5
CID: 5283361
Formula: C12H22O
MW: 182.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight182.30
XLogP34.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count9
Exact Mass182.167065321
Monoisotopic Mass182.167065321
Topological Polar Surface Area17.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity127
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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sc-258268Trans-2-Pentene
sc-258268ATrans-2-Pentene
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Alternative Products

CatalogName
HY-W111720Trans-2-dodecenal
D561102-Dodecenal, Cis & Trans Mixture 10% in Ethanol
TCA083573-Dodecenal
HY-W013627-01Trans, trans-2,4-Decadienal
278700-01Trans, trans-2,4-Hexadienal
OR1070612-01Trans, trans-2,6-Nonadienal
TRC-D210500-10MLtrans,trans-2,4-Decadienal
OR1024777Trans, Trans-2,4-Undecadienal
HY-W127521-01Trans, trans-2,4-Nonadienal
16020998trans,trans-2,4-Hexadienal

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