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(E) -4-Undecenal

CAT: 0931-T29255-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T29255-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
68820-35-9
Target
Others
Related Pathways
Others
Bioactivity
(E) -4-Undecenal is a bioactive chemical.
Smiles
C(/C=C/CCC=O)CCCCC
Molecular Formula
C11H20O
Molecular Weight
168.28
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(E)-4-Undecenal
CAS Number68820-35-9
PubChem CID5283357
IUPAC Name(E)-undec-4-enal
Molecular FormulaC11H20O
Molecular Weight168.28
XLogP3.6
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Heavy Atom Count12
Formal Charge0
Complexity116
SMILES
CCCCCC/C=C/CCC=O
InChI
InChI=1S/C11H20O/c1-2-3-4-5-6-7-8-9-10-11-12/h7-8,11H,2-6,9-10H2,1H3/b8-7+
InChIKey
QGNDNDFXCNBMKI-BQYQJAHWSA-N
Chemical Structure
2D Structure
2D structure of (E)-4-Undecenal
CAS: 68820-35-9
CID: 5283357
Formula: C11H20O
MW: 168.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight168.28
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Exact Mass168.151415257
Monoisotopic Mass168.151415257
Topological Polar Surface Area17.1 Ų
Heavy Atom Count12
Formal Charge0
Complexity116
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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