| Identification | More | [Name]
7-TRIDECANONE | [CAS]
462-18-0 | [Synonyms]
7-TRIDECANONE
DIHEXYL KETONE
DI-N-HEXYL KETONE
ENANTHONE
di-Normal-hexyl ketone
Hexyl ketone
hexylketone
tridecan-7-one
Tridecanone
7-TRIDECANONE, 97+% GC | [EINECS(EC#)]
207-324-3 | [Molecular Formula]
C13H26O | [MDL Number]
MFCD00009543 | [Molecular Weight]
198.34 | [MOL File]
462-18-0.mol |
| Chemical Properties | Back Directory | [Melting point ]
30-32.5 °C(lit.)
| [Boiling point ]
264 °C(lit.)
| [density ]
0.825 g/mL at 25 °C(lit.)
| [refractive index ]
1.4357 (estimate) | [Fp ]
>230 °F
| [storage temp. ]
Sealed in dry,Room Temperature | [form ]
powder to lump to clear liquid | [color ]
White or Colorless to Light yellow | [Odor]
at 100.00?%. may blossom | [FreezingPoint ]
27.0 to 31.0 ℃ | [InChI]
InChI=1S/C13H26O/c1-3-5-7-9-11-13(14)12-10-8-6-4-2/h3-12H2,1-2H3 | [InChIKey]
ULIAPOFMBCCSPE-UHFFFAOYSA-N | [SMILES]
CCCCCCC(=O)CCCCCC | [LogP]
5.053 (est) | [CAS DataBase Reference]
462-18-0(CAS DataBase Reference) | [EPA Substance Registry System]
7-Tridecanone (462-18-0) |
| Safety Data | Back Directory | [Symbol(GHS) ]
GHS07 | [Signal word ]
Warning | [Hazard statements ]
H302-H315-H319-H335 | [Precautionary statements ]
P261-P301+P312-P302+P352-P304+P340-P305+P351+P338 | [WGK Germany ]
3
| [RTECS ]
YD4577000
| [HS Code ]
2914.19.0000 | [Toxicity]
LDLo ivn-mus: 3511 mg/kg APTOA6 37,56,75 |
| Hazard Information | Back Directory | [Chemical Properties]
White solid | [Uses]
7-Tridecanone is an isomer of 2-Tridecanone which is a flavor component of many food products. 7-Tridecanone, however, is much less distributed. It is also used to study the toxicity of narcotic industrial chemicals. | [Preparation]
From Hexyl
magnesium chloride and Heptyl nitrile (Hexyl
cyanide). | [Synthesis Reference(s)]
Journal of the American Chemical Society, 97, p. 6900, 1975 DOI: 10.1021/ja00856a069
Tetrahedron Letters, 36, p. 3223, 1995 DOI: 10.1016/0040-4039(95)00519-I | [Safety Profile]
Moderately toxic by intravenousroute. A flammable liquid. When heated to decompositionit emits acrid smoke and irritating vapors. | [Purification Methods]
Crystallise the ketone from EtOH. [Beilstein 1 H 715.] |
|
| Company Name: |
J & K SCIENTIFIC LTD.
|
| Telephone: |
18210857532 18210857532 |
| Website: |
https://www.jkchemical.com |
| Company Name: |
Energy Chemical
|
| Telephone: |
400-0056266 |
| Website: |
www.energy-chemical.com |
| Company Name: |
Sigma-Aldrich
|
| Telephone: |
021-61415566 800-8193336 |
| Website: |
https://www.sigmaaldrich.cn |
|