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Home > Encyclopedia > Benzoic acid, 3-borono-5-fluoro-, 1-methyl ester

Benzoic acid, 3-borono-5-fluoro-, 1-methyl ester

Benzoic acid, 3-borono-5-fluoro-, 1-methyl ester structure

Benzoic acid, 3-borono-5-fluoro-, 1-methyl ester 

structure
  • CAS No:

    871329-62-3

  • Formula:

    C8H8BFO4

  • Chemical Name:

    Benzoic acid, 3-borono-5-fluoro-, 1-methyl ester

  • Synonyms:

    Benzoic acid,3-borono-5-fluoro-,1-methyl ester;(3-Fluoro-5-methoxycarbonyl-phenyl)boronic acid

  • Categories:

    Organic Chemistry  >  Coordination Complexes

Benzoic acid, 3-borono-5-fluoro-, 1-methyl ester Basic Attributes

197.96

197.96

DTXSID50660113

Characteristics

138-142

Slightly soluble in water.

Safety Information

22

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.

Computed Properties

Molecular Weight:197.96
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:198.0499671
Monoisotopic Mass:198.0499671
Topological Polar Surface Area:66.8
Heavy Atom Count:14
Complexity:212
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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