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Home > Encyclopedia > Hexamethylenediaminetetraacetic acid

Hexamethylenediaminetetraacetic acid

Hexamethylenediaminetetraacetic acid structure

Hexamethylenediaminetetraacetic acid 

structure
  • CAS No:

    1633-00-7

  • Formula:

    C14H24N2O8

  • Chemical Name:

    Hexamethylenediaminetetraacetic acid

  • Synonyms:

    Glycine,N,N′-1,6-hexanediylbis[N-(carboxymethyl)-;Acetic acid,(hexamethylenedinitrilo)tetra-;N,N′-1,6-Hexanediylbis[N-(carboxymethyl)glycine];1,6-Hexanediamine-N,N,N′,N′-tetraacetic acid;Hexamethylenediaminetetraacetic acid;1,6-Hexamethylenediamine-N,N,N′,N′-tetraacetic acid;2-[6-[Bis(carboxymethyl)amino]hexyl-(carboxymethyl)amino]acetic acid;2-([6-[Bis(carboxymethyl)amino]hexyl](carboxymethyl)amino)acetic acid

Description

white to off-white crystalline powder

Hexamethylenediaminetetraacetic acid Basic Attributes

348.35

348.35

216-642-1

2922499990

Characteristics

156

-4.5

1.2294 (rough estimate)

232-236 °C (dec.)(lit.)

482.73°C (rough estimate)

335.5ºC

1.4590 (estimate)

Safety Information

NONH for all modes of transport

3

36/37/38

26-36

Xi

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 99 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

1,6-hexanediamine-N,N,N',N'-tetraacetic acid

Computed Properties

Molecular Weight:348.35
XLogP3:-4.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:15
Exact Mass:348.15326573
Monoisotopic Mass:348.15326573
Topological Polar Surface Area:156
Heavy Atom Count:24
Complexity:369
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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