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1-Dodecylnaphthalene

CAT: 0024-sc-487657Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-487657Size:500 mg
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CAS Number
38641-16-6

Chemical Information

Dodecylnaphthalene
CAS Number38641-16-6
PubChem CID161973
IUPAC Name1-dodecylnaphthalene
Molecular FormulaC22H32
Molecular Weight296.5
XLogP9.8
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count11
Heavy Atom Count22
Formal Charge0
Complexity257
SMILES
CCCCCCCCCCCCC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C22H32/c1-2-3-4-5-6-7-8-9-10-11-15-20-17-14-18-21-16-12-13-19-22(20)21/h12-14,16-19H,2-11,15H2,1H3
InChIKey
UVMGANPLBFFQIO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dodecylnaphthalene
CAS: 38641-16-6
CID: 161973
Formula: C22H32
MW: 296.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight296.5
XLogP39.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count11
Exact Mass296.250401021
Monoisotopic Mass296.250401021
Topological Polar Surface Area0 Ų
Heavy Atom Count22
Formal Charge0
Complexity257
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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