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Home > Encyclopedia > 1-(1,1-Dimethylethyl)-3-nitrobenzene

1-(1,1-Dimethylethyl)-3-nitrobenzene

1-(1,1-Dimethylethyl)-3-nitrobenzene structure

1-(1,1-Dimethylethyl)-3-nitrobenzene 

structure
  • CAS No:

    23132-52-7

  • Formula:

    C10H13NO2

  • Chemical Name:

    1-(1,1-Dimethylethyl)-3-nitrobenzene

  • Synonyms:

    Benzene,1-(1,1-dimethylethyl)-3-nitro-;Benzene,1-tert-butyl-3-nitro-;1-(1,1-Dimethylethyl)-3-nitrobenzene;m-tert-Butylnitrobenzene;1-tert-Butyl-3-nitrobenzene;m-Nitro-tert-butylbenzene

  • Categories:

    Organic Chemistry  >  Hydrocarbons and Derivatives

1-(1,1-Dimethylethyl)-3-nitrobenzene Basic Attributes

179.22

179.22

245-443-2

DTXSID90177699

2904209090

Characteristics

45.8

3.7

1.0645 g/cm3 @ Temp: 25 °C

2 °C

254 °C

87.8±11.5 °C

1.521

Safety Information

2810

6.1

P264, P270, P301+P312, P330, P501

H302

|Warning|H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:179.22
XLogP3:3.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:179.094628657
Monoisotopic Mass:179.094628657
Topological Polar Surface Area:45.8
Heavy Atom Count:13
Complexity:190
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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