(2-Hydroxyethyl)iminodiacetic acid

C₆H₁₁NO₅CAS 93-62-9177.16 g/mol

Open in Covalent MOL file

Alcohol Carboxylic acid Tertiary amine

Properties

Molecular formula: C₆H₁₁NO₅
Molar mass: 177.16 g/mol
Exact mass: 177.0637 Da
Melting point: 170–172 °C
logP: -1.55Crippen estimate
Polar surface area: 98.1 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 6

Hazards

Danger

H302 Harmful if swallowed57.9% of notifiers
H314 Causes severe skin burns and eye damage11.6% of notifiers
H315 Causes skin irritation23.2% of notifiers
H318 Causes serious eye damage64.7% of notifiers
H319 Causes serious eye irritation23.7% of notifiers
H335 May cause respiratory irritation22.6% of notifiers

Aggregated from 190 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, P501

Identifiers

CAS number

93-62-9

SMILES

O=C(O)CN(CCO)CC(=O)O

InChIKey

JYXGIOKAKDAARW-UHFFFAOYSA-N

InChI

InChI=1S/C6H11NO5/c8-2-1-7(3-5(9)10)4-6(11)12/h8H,1-4H2,(H,9,10)(H,11,12)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

16 names · show all

Glycine, N-(carboxymethyl)-N-(2-hydroxyethyl)-
Acetic acid, [(2-hydroxyethyl)imino]di-
N-(Carboxymethyl)-N-(2-hydroxyethyl)glycine
N-(2-Hydroxyethyl)iminodiacetic acid
[(β-Hydroxyethyl)imino]diacetic acid
HEIDA
N-(β-Hydroxyethyl)iminodiacetic acid
Ethanolamine-N,N-diacetic acid
HIMDA
NSC 18474
Chelest EA
Ethanoldiglycine
HIDA
Ethanoldiglycinic acid
2-[(Carboxymethyl)(2-hydroxyethyl)amino]acetic acid
2-[Carboxymethyl(2-hydroxyethyl)amino]acetic acid

Work with (2-Hydroxyethyl)iminodiacetic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Hydroxyethylethylenediaminetriacetic acid150-39-091 % similar Bicine150-25-491 % similar [4-(2-Hydroxy-ethyl)-piperazin-1-yl]-acetic acid124335-65-583 % similar Ethylenediaminetetraacetic acid60-00-473 % similar Pentetic acid67-43-670 % similar Triethylenetetraminehexaacetic acid869-52-370 % similar PDTA1939-36-267 % similar Dota (chelator)60239-18-165 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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