Molecular Identity
Ethanesulfonic acid, 2-[bis(2-hydroxyethyl)amino]-
2-[bis(2-hydroxyethyl)amino]ethanesulfonic acid
PubChem CID: 73243
2-[bis(2-hydroxyethyl)amino]ethanesulfonic acid is a Good's buffer substance, pKa = 7.15 at 20 C. It is an amino sulfonic acid and a BES. It is a conjugate acid of a 2-[bis(2-hydroxyethyl)amino]ethanesulfonate. It is a tautomer of a 2-[bis(2-hydroxyethyl)ammonio]ethanesulfonate.
2D Structure
Properties
C6H15NO5S
Molecular Formula
213.25
Molecular Weight
g/mol
213.0671
Exact Mass
Da
-4.5
XLogP
Drug-like (Lipinski: < 5)
106
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
6
H-Bond Acceptors
204
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Ethanesulfonic acid, 2-[bis(2-hydroxyethyl)amino]-2-(Bis(2-hydroxyethyl)amino)ethanesulphonic acidEthanesulfonic acid, 2-(bis(2-hydroxyethyl)amino)-DTXSID80649852-[bis(2-hydroxyethyl)amino]ethanesulphonic acidRefChem:459873DTXCID0032659Ethanesulfonic acid, 2-bis(2-hydroxyethyl)amino-233-465-510191-18-1N,N-Bis(2-hydroxyethyl)-2-aminoethanesulfonic acidBES2-[Bis(2-Hydroxyethyl)amino]ethanesulfonic acidN,N-Bis(hydroxyethyl)-2-aminoethanesulfonic acidN,N-Bis(2-hydroxyethyl)taurine
Data from PubChem (NCBI)
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Molecular Structure
Ethanesulfonic acid, 2-[bis(2-hydroxyethyl)amino]-
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Drug Network
Trials and conditions connected to Ethanesulfonic acid, 2-[bis(2-hydroxyethyl)amino]-
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