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ω-Pentadecalactone

CAT: 0931-T9327-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0931-T9327-01Size:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
106-02-5
Target
Others
Related Pathways
Others
Purity
0.95002
Bioactivity
ω-Pentadecalactone (Exaltolide) is the fragrance structural group macrocyclic lactone and lactide derivatives used as a fragrance ingredient.
Smiles
O=C1CCCCCCCCCCCCCCO1
Molecular Formula
C15H28O2
Molecular Weight
240.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Pentadecalactone

Cyclopentadecanolide is a macrolide.

CAS Number106-02-5
PubChem CID235414
IUPAC Nameoxacyclohexadecan-2-one
Molecular FormulaC15H28O2
Molecular Weight240.38
XLogP5.8
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count17
Formal Charge0
Complexity189
SMILES
C1CCCCCCCOC(=O)CCCCCC1
InChI
InChI=1S/C15H28O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h1-14H2
InChIKey
FKUPPRZPSYCDRS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pentadecalactone
CAS: 106-02-5
CID: 235414
Formula: C15H28O2
MW: 240.38
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight240.38
XLogP35.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass240.208930132
Monoisotopic Mass240.208930132
Topological Polar Surface Area26.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity189
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

Alternative Products

CatalogName
GTR19216439-01ω-Pentadecalactone
BUP18903?-Pentadecalactone
HY-W035362R-01ω-Pentadecalactone (Standard)
MBS5786241omega-Pentadecalactone
LC-10631.1Omega-Pentadecalactone pure

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