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Decyl aldehyde

CAT: 0931-T8086-04Size: 5 gDry Ice: NoHazardous: No
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CAT#:0931-T8086-04Size:5 g
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CAS Number
112-31-2
Target
Endogenous Metabolite
Related Pathways
Metabolism
Purity
0.98
Bioactivity
Decyl aldehyde is a ten-carbon aldehyde that is a substrate for bacterial luciferase.
Smiles
CCCCCCCCCC=O
Molecular Formula
C10H20O
Molecular Weight
156.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Decanal

Decanal is a saturated fatty aldehyde formally arising from reduction of the carboxy group of capric acid (decanoic acid). It has a role as an antifungal agent, a fragrance and a plant metabolite. It is a n-alkanal, a saturated fatty aldehyde and a medium-chain fatty aldehyde.

CAS Number112-31-2
PubChem CID8175
IUPAC Namedecanal
Molecular FormulaC10H20O
Molecular Weight156.26
XLogP3.8
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Heavy Atom Count11
Formal Charge0
Complexity78
SMILES
CCCCCCCCCC=O
InChI
InChI=1S/C10H20O/c1-2-3-4-5-6-7-8-9-10-11/h10H,2-9H2,1H3
InChIKey
KSMVZQYAVGTKIV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Decanal
CAS: 112-31-2
CID: 8175
Formula: C10H20O
MW: 156.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight156.26
XLogP33.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Exact Mass156.151415257
Monoisotopic Mass156.151415257
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity78.9
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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Alternative Products

CatalogName
MBS3611336-01Decyl aldehyde
HY-W012570SDecyl aldehyde-d2
HY-W012570R-01Decyl aldehyde (Standard)
D00960-01Decyl aldehyde 98%
D00970Decyl aldehyde dimethyl acetal 95%
293188-01Decyl Glucoside
1120-24-7Decyl dimethylamine
40400020-2Decyl Glucopyranoside
OR1026967-01Decyl Ether
OR1012780-01Decyl Alcohol

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