N,N'-Bis(glycyl)cystamine bis(trifluoroacetate)

[2-[2-[2-[(2-azaniumylacetyl)amino]ethyldisulfanyl]ethylamino]-2-oxoethyl]azanium;bis(2,2,2-trifluoroacetate)

CAS: 97314-12-0

Molecular Formula	`C12H20F6N4O6S2`
Molecular Weight	494.4 g/mol
Topological Polar Surface Area	244.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	14
Rotatable Bonds	9
Exact Mass	494.07285
Heavy Atoms	30
Complexity	272.0

Chemical Identifiers

CAS Number	97314-12-0
SMILES	`C(CSSCCNC(=O)C[NH3+])NC(=O)C[NH3+].C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-]`
InChIKey	`ULNSFTVJRAUVAL-UHFFFAOYSA-N`

📖 Product Overview

N,N'-Bis(glycyl)cystamine bis(trifluoroacetate) (CAS: 97314-12-0) is a chemical compound with molecular formula C12H20F6N4O6S2 and molecular weight 494.4 g/mol. Its IUPAC systematic name is [2-[2-[2-[(2-azaniumylacetyl)amino]ethyldisulfanyl]ethylamino]-2-oxoethyl]azanium;bis(2,2,2-trifluoroacetate). Topological Polar Surface Area 244.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 14 Rotatable Bonds 9 Exact Mass 494.07285 Heavy Atoms 30 Complexity 272.0 InChI Key: ULNSFTVJRAUVAL-UHFFFAOYSA-N. SMILES: C(CSSCCNC(=O)C[NH3+])NC(=O)C[NH3+].C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].

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