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Home > Encyclopedia > 1,2-Phenylenedioxydiacetic acid

1,2-Phenylenedioxydiacetic acid

1,2-Phenylenedioxydiacetic acid structure

1,2-Phenylenedioxydiacetic acid 

structure
  • CAS No:

    5411-14-3

  • Formula:

    C10H10O6

  • Chemical Name:

    1,2-Phenylenedioxydiacetic acid

  • Synonyms:

    Acetic acid,2,2′-[1,2-phenylenebis(oxy)]bis-;Acetic acid,(o-phenylenedioxy)di-;2,2′-[1,2-Phenylenebis(oxy)]bis[acetic acid];1,2-Phenylenedioxydiacetic acid;Benzene-1,2-dioxyacetic acid;NSC 10926;2-[2-(2-Hydroxy-2-oxoethoxy)phenoxy]acetic Acid;2-[2-(Carboxymethoxy)phenoxy]acetic acid

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

1,2-Phenylenedioxydiacetic acid Basic Attributes

226.183

226.18

923-773-4

10926

DTXSID70202453

2918990090

Characteristics

93.06000

0.37

White crystal

1.4±0.1 g/cm3

173-174 °C

422.9±25.0 °C at 760 mmHg

169.7±16.7 °C

1.565

Safety Information

NONH for all modes of transport

3

R36/37/38

S26

Xi:Irritant;

P261-P305 + P351 + P338

H315-H319-H335

|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 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:226.18
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:226.04773803
Monoisotopic Mass:226.04773803
Topological Polar Surface Area:93.1
Heavy Atom Count:16
Complexity:226
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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