2-Methoxybenzonitrile

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
255.5±0.0 °C at 760 mmHg

[ Melting Point ]:
24.5ºC

[ Molecular Formula ]:
C₈H₇NO

[ Molecular Weight ]:
133.147

[ Flash Point ]:
103.4±13.7 °C

[ Exact Mass ]:
133.052765

[ PSA ]:
33.02000

[ LogP ]:
1.87

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.527

[ Storage condition ]:
Room temperature.

Click to get detail MSDS

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S37/39

[ RIDADR ]:
3276

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
2926909090

Click to get detail synthetic route

Precursor

DownStream

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Theoretical surface-enhanced Raman spectra study of substituted benzenes II. Density functional theoretical SERS modelling of o-, m-, and p-methoxybenzonitrile.

Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 71(3) , 1074-9, (2008)

The SERS modelling of o-, m-, and p-methoxybenzonitrile has been performed following the same methodology that in Part I. Optimized structure obtained from DFT calculations in a B3LYP-LANL2DZ level of...

[Catalysts for demethylation of methoxybenzonitrile in liquid-phase (author's transl)].

Yakugaku Zasshi 100(6) , 668-71, (1980)

Efficient synthesis of 5-(4'-methyl [1, 1'-biphenyl]-2-yl)-1H-tetrazole. Russell RK and Murray WV.

J. Org. Chem. 58(18) , 5023-24, (1993)

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