Thioacetic acid S-2-(4-aminobutyramido)ethyl ester hydrobromide

2-acetylsulfanylethyl(4-aminobutanoyl)azanium bromide

CAS: 97314-03-9

Molecular Formula	`C8H17BrN2O2S`
Molecular Weight	285.2 g/mol
Topological Polar Surface Area	102.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	7
Exact Mass	284.0194
Heavy Atoms	14
Complexity	174.0

Chemical Identifiers

CAS Number	97314-03-9
SMILES	`CC(=O)SCC[NH2+]C(=O)CCCN.[Br-]`
InChIKey	`OFRWVIABTFBZJS-UHFFFAOYSA-N`

📖 Product Overview

Thioacetic acid S-2-(4-aminobutyramido)ethyl ester hydrobromide (CAS: 97314-03-9) is a chemical compound with molecular formula C8H17BrN2O2S and molecular weight 285.2 g/mol. Its IUPAC systematic name is 2-acetylsulfanylethyl(4-aminobutanoyl)azanium bromide. Topological Polar Surface Area 102.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 7 Exact Mass 284.0194 Heavy Atoms 14 Complexity 174.0 InChI Key: OFRWVIABTFBZJS-UHFFFAOYSA-N. SMILES: CC(=O)SCC[NH2+]C(=O)CCCN.[Br-].

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