Dimethyl iminodiacetate hydrochloride

C6H12ClNO4CAS 39987-25-2197.62 g/mol

OONHOOHCl
EsterSecondary amine

Properties

Molecular formula
C6H12ClNO4
Molar mass
197.62 g/mol
Exact mass
197.0455 Da
logP
-0.66Crippen estimate
Polar surface area
64.6 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
4

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
39987-25-2
SMILES
COC(=O)CNCC(=O)OC.Cl
InChIKey
IIWYYIACSUPJCN-UHFFFAOYSA-N
InChI
InChI=1S/C6H11NO4.ClH/c1-10-5(8)3-7-4-6(9)11-2;/h7H,3-4H2,1-2H3;1H

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

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