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2-(carboxylatomethylsulfanyl)acetate,tris(2-hydroxyethyl)azanium

2-(carboxylatomethylsulfanyl)acetate,tris(2-hydroxyethyl)azanium structure

CAS No:
87298-95-1
Formula:
C16H36N2O10S
Chemical Name:
2-(carboxylatomethylsulfanyl)acetate,tris(2-hydroxyethyl)azanium
Synonyms:
(Carboxymethylthio)acetic acid bis[tris-(2-hydroxyethyl)ammonium]salt; Bisammonium salt of thiodiglycolic acid; bis[2-hydroxy-N,N-bis(2-hydroxyethyl)ethanaminium] 2,2'-sulfanediyldiacetate; Thiodiacetic acid triethanolamine; tris(2-hydroxyethyl)azanium; ACETIC ACID,THIODI-,compd. with 2,2',2''-NITRILOTRIS(ETHANOL) (1:2); 2-(2-oxido-2-oxoethyl)sulfanylacetate; Thiodiacetic acid 2,2',2''-nitrilotriethanol salt (1:2);Expand

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2-(carboxylatomethylsulfanyl)acetate,tris(2-hydroxyethyl)azanium Basic Attributes

Molecular Weight：

448.52900

Exact Mass：

448.20906652 g/mol

DSSTox ID：

DTXSID40236265

Characteristics

PSA：

227.76000

XLogP3：

-3.58060

Boiling Point：

335.4ºC at 760 mmHg

Flash Point：

185ºC

Computed Properties

Molecular Weight:448.5
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:14
Exact Mass:448.20906652
Monoisotopic Mass:448.20906652
Topological Polar Surface Area:236
Heavy Atom Count:29
Complexity:153
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of 2-(carboxylatomethylsulfanyl)acetate,tris(2-hydroxyethyl)azanium

Basic Attributes
Characteristics
Computed Properties

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