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Home > Encyclopedia > Methyl 3,5-dinitrobenzoate

Methyl 3,5-dinitrobenzoate

Methyl 3,5-dinitrobenzoate structure

Methyl 3,5-dinitrobenzoate 

structure
  • CAS No:

    2702-58-1

  • Formula:

    C8H6N2O6

  • Chemical Name:

    Methyl 3,5-dinitrobenzoate

  • Synonyms:

    Benzoic acid,3,5-dinitro-,methyl ester;Methyl 3,5-dinitrobenzoate;3,5-Dinitrobenzoic acid methyl ester;NSC 7317

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

pale yellow crystalline powder

Methyl 3,5-dinitrobenzoate Basic Attributes

226.14

226.14

1252593

220-289-9

UB421R8G90

7317

2916399090

Characteristics

117.94000

2.33600

off-white powder

1.497 g/cm3

107-109 °C

357ºC at 760 mmHg

174.1ºC

1.592

2.81E-05mmHg at 25°C

Safety Information

NONH for all modes of transport

3

22

24/25

Xn

P264, P270, P301+P312, P330, P501

H302

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory.

Methyl 3,5-dinitrobenzoate Use and Manufacturing

Organic intermediates.

Computed Properties

Molecular Weight:226.14
XLogP3:1.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:226.02258592
Monoisotopic Mass:226.02258592
Topological Polar Surface Area:118
Heavy Atom Count:16
Complexity:285
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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