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12-Tricosanone

CAT: 0024-sc-273666Size: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-273666Size:25 g
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CAS Number
540-09-0

Chemical Information

12-Tricosanone

lauron has been reported in Mirabilis jalapa with data available.

CAS Number540-09-0
PubChem CID10888
IUPAC Nametricosan-12-one
Molecular FormulaC23H46O
Molecular Weight338.6
XLogP10.3
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count20
Heavy Atom Count24
Formal Charge0
Complexity222
SMILES
CCCCCCCCCCCC(=O)CCCCCCCCCCC
InChI
InChI=1S/C23H46O/c1-3-5-7-9-11-13-15-17-19-21-23(24)22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3
InChIKey
VARQGBHBYZTYLJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 12-Tricosanone
CAS: 540-09-0
CID: 10888
Formula: C23H46O
MW: 338.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight338.6
XLogP310.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count20
Exact Mass338.354866087
Monoisotopic Mass338.354866087
Topological Polar Surface Area17.1 Ų
Heavy Atom Count24
Formal Charge0
Complexity222
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