3,5-Dimethylphenylacetonitrile

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Names

[ CAS No. ]:
39101-54-7

[ Name ]:
3,5-Dimethylphenylacetonitrile

[Synonym ]:
Benzeneacetonitrile,3,5-dimethyl
EINECS 254-292-1
3,5-dimethylbenzyl cyanide
MFCD00060304
3,5-Dimethylphenylacetonitrile

Chemical & Physical Properties

[ Density]:
0.979 g/cm3

[ Boiling Point ]:
170°C 20mm

[ Melting Point ]:
41-44°C

[ Molecular Formula ]:
C10H11N

[ Molecular Weight ]:
145.20100

[ Flash Point ]:
170°C/20mm

[ Exact Mass ]:
145.08900

[ PSA ]:
23.79000

[ LogP ]:
2.36948

[ Index of Refraction ]:
1.524

[ Storage condition ]:
Refrigerator

Safety Information

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R20/21/22

[ Safety Phrases ]:
S36/37

[ RIDADR ]:
3439

[ WGK Germany ]:
3.0

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
2926909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • (TRIFLUOROMETHYL)DICHLOROPHOSPHINE
  • 1-Bromo-3,5-dimethylbenzene
  • sodium cyanoacetate
  • 3,5-dimethylbenzyl alcohol
  • 3,5-Dimethylaniline
  • Mesitylene
  • a-Bromomesitylene
  • POTASSIUM CYANIDE
  • chloromesitylene
  • Sodium cyanide

DownStream

  • 3,5-Dimethylphenylacetic acid
  • Mesitylene
  • Ethyl 2-(3,5-dimethylphenyl)acetate
  • α,α,3,5-Tetramethyl-benzeneacetonitrile

Customs

[ 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%

Related Compounds

  • 3,5-DIBROMO-4-HYDROXYCINNAMIC ACID
  • 3,5-dibromo-4-[(4-hydroxyphenyl)methyl]-2,6-dimethylphenol
  • 3,5-dibromo-4-(methoxymethyl)-2,6-dimethylphenol
  • 3,5-dimethyl-1-benzofuran-2-carbonyl chloride
  • 3,5-dimethoxybenzylmagnesium chloride
  • 3,5-Di-O-p-chlorobenzoyl α-Floxuridine