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Home > Encyclopedia > 1-Methyl 4-borono-3-nitrobenzoate

1-Methyl 4-borono-3-nitrobenzoate

1-Methyl 4-borono-3-nitrobenzoate structure

1-Methyl 4-borono-3-nitrobenzoate 

structure
  • CAS No:

    85107-55-7

  • Formula:

    C8H8BNO6

  • Chemical Name:

    1-Methyl 4-borono-3-nitrobenzoate

  • Synonyms:

    Benzoic acid,4-borono-3-nitro-,1-methyl ester;Benzoic acid,4-borono-3-nitro-,methyl ester;1-Methyl 4-borono-3-nitrobenzoate;[4-(Methoxycarbonyl)-2-nitrophenyl]boronic acid

  • Categories:

    Organic Chemistry  >  Coordination Complexes

1-Methyl 4-borono-3-nitrobenzoate Basic Attributes

224.96

224.96

DTXSID60378494

Characteristics

1.45±0.1 g/cm3

160-171°C

441.0±55.0 °C(Predicted)

7.00±0.53

Safety Information

IRRITANT

36/37/38-22

26-36/37/39-36

Xi,Xn

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1-Methyl 4-borono-3-nitrobenzoate Use and Manufacturing

suzuki reaction

Computed Properties

Molecular Weight:224.97
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:225.0444671
Monoisotopic Mass:225.0444671
Topological Polar Surface Area:113
Heavy Atom Count:16
Complexity:278
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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