2,4,6-Tri-tert-butylnitrobenzene

Names

[ CAS No. ]:
4074-25-3

[ Name ]:
2,4,6-Tri-tert-butylnitrobenzene

[Synonym ]:
MFCD00008818
1,3,5-tritert-butyl-2-nitrobenzene
EINECS 223-789-5
1,3,5-Tri-tert-butyl-2-nitrobenzene

Chemical & Physical Properties

[ Density]:
0.967g/cm3

[ Boiling Point ]:
326ºC at 760 mmHg

[ Melting Point ]:
205-206 °C(lit.)

[ Molecular Formula ]:
C₁₈H₂₉NO₂

[ Molecular Weight ]:
291.42800

[ Flash Point ]:
108.7ºC

[ Exact Mass ]:
291.22000

[ PSA ]:
45.82000

[ LogP ]:
6.01050

[ Index of Refraction ]:
1.495

MSDS

Click to get detail MSDS

Safety Information

[ Safety Phrases ]:
S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ HS Code ]:
2904209090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2904209090

[ Summary ]:
2904209090 derivatives containing only nitro or only nitroso groups。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

Articles

A solid-state nitrogen-15 NMR and ab initio study of nitrobenzenes.

J. Org. Chem. 68(11) , 4258-64, (2003)

Insight into the unexpectedly small range of isotropic nitrogen chemical shifts in nitrobenzene derivatives is gained through measurements of the chemical shift (CS) tensor by solid-state NMR experime...