Chemical Properties of 1,6-Diaminohexane-N,N,N',N'-tetraacetic acid (CAS 1633-00-7)

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

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InChI
InChI=1S/C14H24N2O8/c17-11(18)7-15(8-12(19)20)5-3-1-2-4-6-16(9-13(21)22)10-14(23)24/h1-10H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)
InChI Key
YGDVXSDNEFDTGV-UHFFFAOYSA-N
Formula
C14H24N2O8
SMILES
O=C(O)CN(CCCCCCN(CC(=O)O)CC(=O)O)CC(=O)O
Molecular Weight1
348.35
CAS
1633-00-7
Other Names
  • Glycine, N,N'-1,6-hexanediylbis[N-(carboxymethyl)-
  • Hexamethylenediamine-N,N,N',N'-tetraacetic acid
  • Hexamethylenediamine-N,N,N',N'-tetracetic acid
  • hexamethylenediaminetetraacetic acid
Sources

Physical Properties

Property Value Unit Source
Δcsolid -6995.30 ± 2.40 kJ/mol NIST
Δf -774.40 kJ/mol Joback Calculated Property
Δfgas -1256.47 kJ/mol Joback Calculated Property
Δfsolid -1943.30 ± 0.90 kJ/mol NIST
Δfus 60.81 kJ/mol Joback Calculated Property
Δvap 144.54 kJ/mol Joback Calculated Property
logPoct/wat -0.51 Crippen Calculated Property
Pc 2640.67 kPa Joback Calculated Property
Tboil 1128.80 K Joback Calculated Property
Tc 1444.96 K Joback Calculated Property
Tfus 755.48 K Joback Calculated Property
Vc 0.96 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 880.58 J/mol×K 1128.8 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-CH2- 10
>C=O (nonring) 4
>N- 2
-OH (alcohol) 4

Similar Compounds

2,2'-(Hexylamino)diethanol. Ethanol, 2,2'-(dodecylimino)bis-. 2-(Hexamethyleneimino)ethanol. N-(2-Hydroxyethyl)iminodiacetic acid. Noname. 1-Piperidineethanol. N-butyl-diethanolamine hydrochloride. Ethanol, 2,2'-(butylimino)bis-. 1-Piperidinepropanoic acid. 1-Piperidinepropionic acid, hydrochloride. Acetic acid, nitrilotri-, trisodium salt. Acetic acid, nitrilotri-, disodium salt. Ethanol, 2-(dibutylamino)-. Methoxyacetamide, n,n-dihexyl-. Ethylene diamine tetra-acetic acid, disodium salt.

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