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Product Name: 12-Tricosanone
CAS Registry Number: 540-09-0
Synonyms: 12-Tricosanone ; 4-01-00-03408 (Beilstein Handbook Reference) ; AI3-11254 ; BRN 1789685 ; Di-n-undecyl ketone ; Diundecyl ketone ; EINECS 208-735-0 ; Lauron ; Lauron (VAN) ; Laurone ; NSC 2200 ; Undecyl ketone
Systematic Name: 12-Tricosanone
IUPAC Name: tricosan-12-one
Molecular Weight: 338.61074 [g/mol]
Molecular Formula: C23H46O
XLogP3-AA: 10.3
H-Bond Acceptor: 1
Melting Point: 66-68°C
Surface Tension: 30.4 dyne/cm
Density: 0.835 g/cm3
Flash Point: 71.9 °C
Enthalpy of Vaporization: 65.6 kJ/mol
Boiling Point: 404.5 °C at 760 mmHg
Vapour Pressure: 9.39E-07 mmHg at 25°C
Following is the molecular structure of 12-Tricosanone (CAS NO.540-09-0) is:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 56mg/kg (56mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#03438, |
Reported in EPA TSCA Inventory.
Poison by intravenous route. A flammable liquid. When heated to decomposition it emits acrid smoke and irritating fumes. See also KETONES.
RTECS: YD0805000
DOT Classification: 3; Label: Flammable Liquid
Descriptors computed from structure, you can know some information about 12-Tricosanone (CAS NO.540-09-0) :
Canonical 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
Exact Mass: 338.354866
MonoIsotopic Mass: 338.354866
Topological Polar Surface Area: 17.1
Heavy Atom Count: 24