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Delmopinol

CAT: 0013-GTR19236418-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19236418-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Delmopinol is a small molecule antimicrobial agent used in oral care research to prevent dental biofilm formation. It is applied in both in vitro and in vivo studies investigating plaque control and antimicrobial strategies, as supported by published scientific literature.
CAS Number
79874-76-3
Field of Research
Infectious Disease & Virology, Pharmacology & Drug Discovery
Smiles
OCCN1CCOCC1CCCC (CCC) CCC
Molecular Formula
C16H33NO2
Molecular Weight
271.44
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Delmopinol

Delmopinol is a member of morpholines.

CAS Number79874-76-3
PubChem CID57337
IUPAC Name2-[3-(4-propylheptyl)morpholin-4-yl]ethanol
Molecular FormulaC16H33NO2
Molecular Weight271.44
XLogP4
Topological Polar Surface Area32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Heavy Atom Count19
Formal Charge0
Complexity205
SMILES
CCCC(CCC)CCCC1COCCN1CCO
InChI
InChI=1S/C16H33NO2/c1-3-6-15(7-4-2)8-5-9-16-14-19-13-11-17(16)10-12-18/h15-16,18H,3-14H2,1-2H3
InChIKey
QSFOWAYMMZCQNF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Delmopinol
CAS: 79874-76-3
CID: 57337
Formula: C16H33NO2
MW: 271.44
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight271.44
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Exact Mass271.251129295
Monoisotopic Mass271.251129295
Topological Polar Surface Area32.7 Ų
Heavy Atom Count19
Formal Charge0
Complexity205
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-B0050Delmopinol
HY-B0050ADelmopinol (hydrochloride)
A23970-10Delmopinol hydrochloride 10mg
A23970-5Delmopinol hydrochloride 5mg
A23970-1Delmopinol hydrochloride 1mg
A23970-50Delmopinol hydrochloride 50mg

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