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3-hexadecoxypropan-1-ol

CAT: 1410-M37487-01Size: 1 EachDry Ice: NoHazardous: No
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Description
3-hexadecoxypropan-1-ol (3- (Hexadecyloxy) -1-propanol) is a surfactant commonly used in inks, coatings and adhesives.
CAS Number
23377-40-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
300.52
Molecular Formula
C19H40O2
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

3-(Hexadecyloxy)propan-1-ol

See also: PPG-30 Cetyl ether (annotation moved to); Hexadecan-1-ol, propoxylated (annotation moved to); Polyoxypropylene cetyl ether (annotation moved to).

CAS Number23377-40-4
PubChem CID165753
IUPAC Name3-hexadecoxypropan-1-ol
Molecular FormulaC19H40O2
Molecular Weight300.5
XLogP7.5
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count18
Heavy Atom Count21
Formal Charge0
Complexity171
SMILES
CCCCCCCCCCCCCCCCOCCCO
InChI
InChI=1S/C19H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-19-16-17-20/h20H,2-19H2,1H3
InChIKey
YDCSFYSJEYSCBP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(Hexadecyloxy)propan-1-ol
CAS: 23377-40-4
CID: 165753
Formula: C19H40O2
MW: 300.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight300.5
XLogP37.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count18
Exact Mass300.302830514
Monoisotopic Mass300.302830514
Topological Polar Surface Area29.5 Ų
Heavy Atom Count21
Formal Charge0
Complexity171
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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