2846. Decalin(R) (DuPont)

Nomenclature

CAS number: 91-17-8
Decahydronaphthalene; perhydronaphthalene; bicyclo[4.4.0]decane; naphthalane; naphthane; DeKalin.
C10H18; mol wt 138.25.
C 86.88%, H 13.12%.

Description and references

Occurs in two forms: cis and trans. Hydrogenation of naphthalene in glacial acetic acid in the presence of platinum catalyst at 25° and 130 atm yields a mixture of 77% cis-Decalin and 23% trans-Decalin. Hydrogenation of Tetralin under the same conditions yields almost only cis-Decalin: Baker, Schuetz, J. Am. Chem. Soc. 69, 1250 (1947). Hydrogenation of Δ4a(8a)-octalin in ethanol in the presence of platinum yields trans-Decalin as the main component: Linstead et al., J. Chem. Soc. 1937, 1136. Separation of trans- and cis-forms: Seyer, Walker, J. Am. Chem. Soc. 60, 2125 (1938). Prepn of trans-Decalin from cis-Decalin: Zelinsky, Ber. 65, 1299 (1932). Conformation studies: Barton, J. Chem. Soc. 1948, 340; Moniz, Dixon, J. Am. Chem. Soc. 83, 1671 (1961). Toxicity data: Smyth et al., Arch. Ind. Hyg. Occup. Med. 4, 119 (1951).

Chemical structure

Properties

Liquid. Slight odor resembling menthol. Pure Decalin does not smell of naphthalene. Volatile with steam. The commercial product may be practically all trans-Decalin, or a mixture contg up to 60% cis-Decalin. The commercial mixture has a flash pt (closed cup) of about 136°F (58°C). Autoignition temp 504°F. Insol in water. Very sol in alcohol, methanol, ether, chloroform. Miscible with propyl and isopropyl alcohol; miscible with most ketones and esters. LD50 orally in rats: 4.2 g/kg; LC (in air) in rats: 500 ppm (Smyth).

Derivative

cis-Form.

Properties

mp -43.26°. bp 195.7°; bp9 67.0°. d420 0.8963. nD20 1.48113.

Derivative

trans-Form.

Properties

mp -30.4°. bp 187.25°; bp9 62.0°. d420 0.8700. nD20 1.46968.

Use

Solvent for naphthalene, fats, resins, oils, waxes; used instead of turpentine in lacquers, shoe polishes, floor waxes. In motor fuel and lubricants. As patent fuel in stoves.