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| | 3,3,5,5-Tetramethylcyclohexanone Basic information |
| Product Name: | 3,3,5,5-Tetramethylcyclohexanone | | Synonyms: | NSC 91511;3,3,5,5-Tetramethylcyclohexanone,98%;3,3,5,5-TetraMethylcyclohexanone 98%; Cyclohexanone,3,3,5,5-tetramethyl-;3,3,5,5-Tetramethyl-1-cyclohexanone;3,3,5,5-tetramethylcyclohexylone;3,3,5,5-tetramethylcyclohexan-1-one;3,3,5,5-Tetramethylcyclohexanone | | CAS: | 14376-79-5 | | MF: | C10H18O | | MW: | 154.25 | | EINECS: | 238-350-3 | | Product Categories: | C10;Carbonyl Compounds;API intermediates;Ketones;Building Blocks;Carbonyl Compounds;Chemical Synthesis;Organic Building Blocks | | Mol File: | 14376-79-5.mol |  |
| | 3,3,5,5-Tetramethylcyclohexanone Chemical Properties |
| Melting point | 11-12 °C | | Boiling point | 200-203 °C | | density | 0.881 g/mL at 25 °C (lit.) | | refractive index | n20/D 1.451(lit.) | | Fp | 164 °F | | storage temp. | Sealed in dry,Room Temperature | | form | Liquid | | color | Clear colorless to slightly yellow | | BRN | 1237421 | | InChI | 1S/C10H18O/c1-9(2)5-8(11)6-10(3,4)7-9/h5-7H2,1-4H3 | | InChIKey | OQJMHUOCLRCSED-UHFFFAOYSA-N | | SMILES | CC1(C)CC(=O)CC(C)(C)C1 | | CAS DataBase Reference | 14376-79-5(CAS DataBase Reference) |
| Safety Statements | 23-24/25 | | WGK Germany | 3 | | HS Code | 29142990 | | Storage Class | 10 - Combustible liquids |
| | 3,3,5,5-Tetramethylcyclohexanone Usage And Synthesis |
| Chemical Properties | Clear colorless to slightly yellow liquid | | Uses | 3,3,5,5-Tetramethylcyclohexanone (cas# 14376-79-5) is a useful research chemical and a pharmaceutical intermediate. | | Synthesis Reference(s) | Tetrahedron Letters, 25, p. 3463, 1984 DOI: 10.1016/S0040-4039(01)91048-2 | | Purification Methods | Purify the ketone first through a 24inch column packed with Raschig rings, then a 40cm Vigreux column (p 11) under reduced pressure (b 69-69.3o/7mm, see above). The oxime has m 144-145o (from 60% EtOH), and the semicarbazone has m 196-197o, 197-198o (214.5o, 217-218o) [Karasch & Tawney J Am Chem Soc 63 2308 1941, UV: Sandris & Ourisson Bull Soc Chim Fr 958 1956]. [Beilstein 7 III 163, 7 IV 89.] |
| | 3,3,5,5-Tetramethylcyclohexanone Preparation Products And Raw materials |
| Preparation Products | Cyclohexanol, 1-ethyl-3,3,5,5-tetramethyl--->Cyclohexanecarboxaldehyde, 2,2,4,4-tetramethyl-6-oxo--->Cyclohexane, 1,1-difluoro-3,3,5,5-tetramethyl--->1-Amino-3,3,5,5-tetramethylcyclohexanecarboxylic acid-->1,3,3,5,5-Pentamethylcyclohexanol |
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