Trisodium-2-(hydroxycyclohexyl)ethylenediamine triacetate

trisodium;2-[carboxylatomethyl-[2-[carboxylatomethyl-(2-hydroxycyclohexyl)amino]ethyl]amino]acetate

CAS: 63938-38-5

Molecular Formula	`C14H21N2Na3O7`
Molecular Weight	398.29 g/mol
Topological Polar Surface Area	147.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	7
Exact Mass	398.1042
Heavy Atoms	26
Complexity	397.0

Chemical Identifiers

CAS Number	63938-38-5
SMILES	`C1CCC(C(C1)N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])O.[Na+].[Na+].[Na+]`
InChIKey	`UGSWGDUORNDBTD-UHFFFAOYSA-K`

📖 Product Overview

Trisodium-2-(hydroxycyclohexyl)ethylenediamine triacetate (CAS: 63938-38-5) is a chemical compound with molecular formula C14H21N2Na3O7 and molecular weight 398.29 g/mol. Its IUPAC systematic name is trisodium;2-[carboxylatomethyl-[2-[carboxylatomethyl-(2-hydroxycyclohexyl)amino]ethyl]amino]acetate. Topological Polar Surface Area 147.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 9 Rotatable Bonds 7 Exact Mass 398.1042 Heavy Atoms 26 Complexity 397.0 InChI Key: UGSWGDUORNDBTD-UHFFFAOYSA-K. SMILES: C1CCC(C(C1)N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])O.[Na+].[Na+].[Na+].

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