D251
Decahydronaphthalene, mixture of cis + trans
reagent grade, 98%
Synonym(s):
Decalin™
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About This Item
Empirical Formula (Hill Notation):
C10H18
CAS Number:
Molecular Weight:
138.25
UNSPSC Code:
12352001
NACRES:
NA.21
PubChem Substance ID:
EC Number:
202-046-9
Beilstein/REAXYS Number:
878165
MDL number:
Assay:
98%
Grade:
reagent grade
Bp:
189-191 °C (lit.)
Vapor pressure:
42 mmHg ( 92 °C), 741 mmHg ( 188 °C)
grade
reagent grade
Quality Level
vapor density
4.76 (vs air)
vapor pressure
42 mmHg ( 92 °C), 741 mmHg ( 188 °C)
assay
98%
form
liquid
autoignition temp.
482 °F
expl. lim.
0.7-4.9 %, 100 °F
dilution
(for analytical testing)
refractive index
n20/D 1.474 (lit.)
bp
189-191 °C (lit.)
mp
−125 °C (lit.)
density
0.896 g/mL at 25 °C (lit.)
SMILES string
C1CCC2CCCCC2C1
InChI
1S/C10H18/c1-2-6-10-8-4-3-7-9(10)5-1/h9-10H,1-8H2
InChI key
NNBZCPXTIHJBJL-UHFFFAOYSA-N
General description
Decahydronaphthalene, mixture of cis + trans is a bicyclic organic compound that can be used as an industrial solvent. It can be prepared by the complete catalytic hydrogenation of naphthalene or tetralin.
Application
Decahydronaphthalene, mixture of cis+ trans can be used as a solvent in the:
- Distannoxane-catalyzed synthesis of aliphatic polyesters via polycondensation.
- Intramolecular carbonyl-ene cyclocondensation of oxygenated o-phenylallylbenzaldehydes to synthesize substituted naphthalenes.
Legal Information
Decalin is a trademark of Sigma-Aldrich Co. LLC
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signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 3 Inhalation - Aquatic Acute 1 - Aquatic Chronic 1 - Asp. Tox. 1 - Eye Dam. 1 - Flam. Liq. 3 - Skin Corr. 1C
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
134.6 °F - closed cup
flash_point_c
57 °C - closed cup
Regulatory Information
危险化学品
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Joseph B Lim et al.
The journal of physical chemistry. B, 116(1), 203-210 (2011-12-06)
A modification of the CHARMM36 lipid force field (C36) for cholesterol, henceforth, called C36c, is reported. A fused ring compound, decalin, was used to model the steroid section of cholesterol. For decalin, C36 inaccurately predicts the heat of vaporization (~10
Franco Cataldo et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 77(5), 998-1004 (2010-09-25)
Oleum (fuming sulphuric acid), a well known superacid, was used as medium for the generation of the radical cation of a series of selected PAHs. The resulting radical cation spectra were studied by electronic absorption spectroscopy. Not only common PAHs
D Kruk et al.
The Journal of chemical physics, 137(4), 044512-044512 (2012-08-03)
(1)H relaxation dispersion of decalin and glycerol solutions of nitroxide radicals, 4-oxo-TEMPO-d(16)-(15)N and 4-oxo-TEMPO-d(16)-(14)N was measured in the frequency range of 10 kHz-20 MHz (for (1)H) using STELAR Field Cycling spectrometer. The purpose of the studies is to reveal how
Global Trade Item Number
| SKU | GTIN |
|---|---|
| D251-4L | 04061833562291 |
| D251-18L-CS | 04061837717093 |
| D251-1L | 04061837227080 |
| D251-500ML | 04061833562307 |