YBX

(ethylsulfanyl)acetic acid

Created:2023-01-23
Last modified:  2024-10-16

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Chemical Details

Formal Charge0
Atom Count15
Chiral Atom Count0
Bond Count14
Aromatic Bond Count0
2D diagram of YBX

Chemical Component Summary

Name(ethylsulfanyl)acetic acid
Systematic Name (OpenEye OEToolkits)2-ethylsulfanylethanoic acid
FormulaC4 H8 O2 S
Molecular Weight120.17
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(O)CSCC
SMILESCACTVS3.385CCSCC(O)=O
SMILESOpenEye OEToolkits2.0.7CCSCC(=O)O
Canonical SMILESCACTVS3.385 CCSCC(O)=O
Canonical SMILESOpenEye OEToolkits2.0.7 CCSCC(=O)O
InChIInChI1.06 InChI=1S/C4H8O2S/c1-2-7-3-4(5)6/h2-3H2,1H3,(H,5,6)
InChIKeyInChI1.06 VJIKFWJCVWFZIN-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 69387