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5-Decanone

CAT: 0931-T29451-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T29451-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
820-29-1
Target
Others
Related Pathways
Others
Bioactivity
5-Decanone is a biochemical.
Smiles
O=C(CCCC)CCCCC
Molecular Formula
C10H20O
Molecular Weight
156.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-Decanone

5-decanone has been reported in Punica granatum with data available.

CAS Number820-29-1
PubChem CID13175
IUPAC Namedecan-5-one
Molecular FormulaC10H20O
Molecular Weight156.26
XLogP3.2
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count7
Heavy Atom Count11
Formal Charge0
Complexity97
SMILES
CCCCCC(=O)CCCC
InChI
InChI=1S/C10H20O/c1-3-5-7-9-10(11)8-6-4-2/h3-9H2,1-2H3
InChIKey
JDPQWHLMBJZURR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Decanone
CAS: 820-29-1
CID: 13175
Formula: C10H20O
MW: 156.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight156.26
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count7
Exact Mass156.151415257
Monoisotopic Mass156.151415257
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity97
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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