bis(2-[bis(2-hydroxyethyl)amino]ethanol)2-[3-(carboxymethylsulfanyl)phenyl]sulfanylacetic acid

bis(2-[bis(2-hydroxyethyl)amino]ethanol);2-[3-(carboxymethylsulfanyl)phenyl]sulfanylacetic acid

CAS: 87299-02-3

Molecular Formula	`C22H40N2O10S2`
Molecular Weight	556.7 g/mol
Topological Polar Surface Area	253.0 A2
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	14
Rotatable Bonds	18
Exact Mass	556.21246
Heavy Atoms	36
Complexity	289.0

Chemical Identifiers

CAS Number	87299-02-3
SMILES	`C1=CC(=CC(=C1)SCC(=O)O)SCC(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO`
InChIKey	`RCMKDDAHAROQBY-UHFFFAOYSA-N`

📖 Product Overview

bis(2-[bis(2-hydroxyethyl)amino]ethanol)2-[3-(carboxymethylsulfanyl)phenyl]sulfanylacetic acid (CAS: 87299-02-3) is a chemical compound with molecular formula C22H40N2O10S2 and molecular weight 556.7 g/mol. Its IUPAC systematic name is bis(2-[bis(2-hydroxyethyl)amino]ethanol);2-[3-(carboxymethylsulfanyl)phenyl]sulfanylacetic acid. Topological Polar Surface Area 253.0 A2 Hydrogen Bond Donors 8 Hydrogen Bond Acceptors 14 Rotatable Bonds 18 Exact Mass 556.21246 Heavy Atoms 36 Complexity 289.0 InChI Key: RCMKDDAHAROQBY-UHFFFAOYSA-N. SMILES: C1=CC(=CC(=C1)SCC(=O)O)SCC(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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