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110477

trans-Decahydronaphthalene

Name: <I>trans</I>-Decahydronaphthalene
Brand: ALDRICH

99%

Synonym(s):

trans-Decalin^™

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About This Item

Empirical Formula (Hill Notation):

C₁₀H₁₈

CAS Number:

493-02-7

Molecular Weight:

138.25

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24846987

EC Number:

207-771-4

Beilstein/REAXYS Number:

2036251

MDL number:

MFCD00064191

Assay:

99%

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vapor density

4.76 (vs air)

Quality Level

100

vapor pressure

42 mmHg ( 92 °C)

assay

99%

autoignition temp.

482 °F

expl. lim.

0.7-4.9 %, 100 °F

refractive index

n20/D 1.469 (lit.)

bp

185 °C/756 mmHg (lit.)

mp

−32 °C (lit.)

density

0.87 g/mL at 25 °C (lit.)

SMILES string

[H][C@@]12CCCC[C@@]1([H])CCCC2

InChI

1S/C10H18/c1-2-6-10-8-4-3-7-9(10)5-1/h9-10H,1-8H2/t9-,10-

InChI key

NNBZCPXTIHJBJL-MGCOHNPYSA-N

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Related Categories

Chemistry & Biochemicals

Chemical Building Blocks

Organic Building Blocks

Application

trans-Decahydronaphthalene has been used to measure absolute photoionization and dissociative photoionization cross-section for photon energies.

Legal Information

Decalin is a trademark of Sigma-Aldrich Co. LLC

pictograms

GHS02,GHS06,GHS08,GHS05,GHS09

signalword

Danger

hcodes

H226,H304,H314,H331,H411

pcodes

P210 - P280 - P301 + P330 + P331 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338

Hazard Classifications

Acute Tox. 3 Inhalation - Aquatic Chronic 2 - Asp. Tox. 1 - Eye Dam. 1 - Flam. Liq. 3 - Skin Corr. 1C

Storage Class

3 - Flammable liquids

flash_point_f

136.4 °F - closed cup

flash_point_c

58 °C - closed cup

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

Regulatory Information

危险化学品

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Certificates of Analysis (COA)

Lot/Batch Number

14221HN

00409AY

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Cyclization reaction dynamics of an inverse type diarylethene derivative as revealed by time-resolved absorption and fluorescence spectroscopies.

Hikaru Sotome et al.

Physical chemistry chemical physics : PCCP, 21(17), 8623-8632 (2019-03-01)

Photocyclization reaction dynamics of an inverse type diarylethene derivative was investigated in alkane solutions by means of ultrafast laser spectroscopies. Femtosecond transient absorption spectroscopy showed that the Franck-Condon state formed by photoexcitation is geometrically relaxed to a transient species within

Determination of absolute photoionization cross-sections of alkanes and cyclo-alkanes.

Zhongyue Zhou et al.

Rapid communications in mass spectrometry : RCM, 24(9), 1335-1342 (2010-04-15)

Absolute photoionization and dissociative photoionization cross-sections of eleven n-alkanes (n-pentane, n-hexane, n-heptane, n-nonane, n-decane, n-undecane, n-dodecane, n-tridecane, n-tetradecane, n-pentadecane and n-hexadecane), three cyclo-alkanes (cyclopentane, methylcyclohexane and trans-decahydronaphthalene) and iso-octane were measured for photon energies from the ionization thresholds to 11.5

Immunosuppressive decalin derivatives from red yeast rice.

Lin Zhu et al.

Journal of natural products, 75(4), 567-571 (2012-03-08)

Five new decalin derivatives (1-5), together with two known compounds (6 and 7), were isolated from the ethyl acetate extract of red yeast rice. Their structures were elucidated by means of NMR and mass spectroscopic analyses. Monascusic lactone A (1)

Update of the cholesterol force field parameters in CHARMM.

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

Spontaneous crystalline-to-amorphous phase transformation of organic or medicinal compounds in the presence of porous media, part 1: thermodynamics of spontaneous amorphization.

Ken K Qian et al.

Journal of pharmaceutical sciences, 100(7), 2801-2815 (2011-02-22)

Spontaneous crystalline-to-amorphous phase transformation of organic or medicinal molecules in the presence of mesoporous materials has been observed, for which pathway was suggested to be via the vapor phase, that is, sublimation of the crystalline molecules followed by adsorption on

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Global Trade Item Number

SKU	GTIN
110477-10G	04061837759871

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